Wednesday, October 31, 2012

http://ChemLookup.com Compounds




CAS RN: 136513-36-5
CAS Name: 3-hexadecoxy-1-propanol
OPENEYE Name: 3-hexadecoxypropan-1-ol
IUPAC Name: 3-hexadecoxypropan-1-ol
SYSTEMATIC NAME: 3-hexadecoxypropan-1-ol
MOLECULAR FORMULA: C19H40O2
MOLECULAR WEIGHT: 300.5197
SMILES: CCCCCCCCCCCCCCCCOCCCO
Structure:

CAS RN: 73212-05-2
CAS Name: 3-hexadecoxy-1-propanol
OPENEYE Name: 3-hexadecoxypropan-1-ol
IUPAC Name: 3-hexadecoxypropan-1-ol
SYSTEMATIC NAME: 3-hexadecoxypropan-1-ol
MOLECULAR FORMULA: C19H40O2
MOLECULAR WEIGHT: 300.5197
SMILES: CCCCCCCCCCCCCCCCOCCCO
Structure:

CAS RN: 42610-80-0
CAS Name: 1,3-diisocyanato-2-methylbenzene; hexanedioic acid; propane-1,2-diol
OPENEYE Name: adipic acid; 1,3-diisocyanato-2-methyl-benzene; propane-1,2-diol
IUPAC Name: 1,3-diisocyanato-2-methylbenzene; hexanedioic acid; propane-1,2-diol
SYSTEMATIC NAME: 1,3-diisocyanato-2-methyl-benzene; hexanedioic acid; propane-1,2-diol
MOLECULAR FORMULA: C18H24N2O8
MOLECULAR WEIGHT: 396.39176
SMILES: CC1=C(C=CC=C1N=C=O)N=C=O.CC(CO)O.C(CCC(=O)O)CC(=O)O
Structure:

CAS RN: 11116-57-7
CAS Name: 1,3-diisocyanato-2-methylbenzene; ethane-1,2-diol; hexanedioic acid
OPENEYE Name: adipic acid; 1,3-diisocyanato-2-methyl-benzene; ethylene glycol
IUPAC Name: 1,3-diisocyanato-2-methylbenzene; ethane-1,2-diol; hexanedioic acid
SYSTEMATIC NAME: 1,3-diisocyanato-2-methyl-benzene; ethane-1,2-diol; hexanedioic acid
MOLECULAR FORMULA: C17H22N2O8
MOLECULAR WEIGHT: 382.36518
SMILES: CC1=C(C=CC=C1N=C=O)N=C=O.C(CCC(=O)O)CC(=O)O.C(CO)O
Structure:

CAS RN: 151486-17-8
CAS Name: 1,3-diisocyanato-2-methylbenzene; ethane-1,2-diol; hexanedioic acid
OPENEYE Name: adipic acid; 1,3-diisocyanato-2-methyl-benzene; ethylene glycol
IUPAC Name: 1,3-diisocyanato-2-methylbenzene; ethane-1,2-diol; hexanedioic acid
SYSTEMATIC NAME: 1,3-diisocyanato-2-methyl-benzene; ethane-1,2-diol; hexanedioic acid
MOLECULAR FORMULA: C17H22N2O8
MOLECULAR WEIGHT: 382.36518
SMILES: CC1=C(C=CC=C1N=C=O)N=C=O.C(CCC(=O)O)CC(=O)O.C(CO)O
Structure:

CAS RN: 37324-51-9
CAS Name: 1,3-diisocyanato-2-methylbenzene; ethane-1,2-diol; hexanedioic acid
OPENEYE Name: adipic acid; 1,3-diisocyanato-2-methyl-benzene; ethylene glycol
IUPAC Name: 1,3-diisocyanato-2-methylbenzene; ethane-1,2-diol; hexanedioic acid
SYSTEMATIC NAME: 1,3-diisocyanato-2-methyl-benzene; ethane-1,2-diol; hexanedioic acid
MOLECULAR FORMULA: C17H22N2O8
MOLECULAR WEIGHT: 382.36518
SMILES: CC1=C(C=CC=C1N=C=O)N=C=O.C(CCC(=O)O)CC(=O)O.C(CO)O
Structure:

CAS RN: 51281-06-2
CAS Name: 1,3-diisocyanato-2-methylbenzene; ethane-1,2-diol; hexanedioic acid
OPENEYE Name: adipic acid; 1,3-diisocyanato-2-methyl-benzene; ethylene glycol
IUPAC Name: 1,3-diisocyanato-2-methylbenzene; ethane-1,2-diol; hexanedioic acid
SYSTEMATIC NAME: 1,3-diisocyanato-2-methyl-benzene; ethane-1,2-diol; hexanedioic acid
MOLECULAR FORMULA: C17H22N2O8
MOLECULAR WEIGHT: 382.36518
SMILES: CC1=C(C=CC=C1N=C=O)N=C=O.C(CCC(=O)O)CC(=O)O.C(CO)O
Structure:

CAS RN: 53241-28-4
CAS Name: 1,3-diisocyanato-2-methylbenzene; ethane-1,2-diol; hexanedioic acid
OPENEYE Name: adipic acid; 1,3-diisocyanato-2-methyl-benzene; ethylene glycol
IUPAC Name: 1,3-diisocyanato-2-methylbenzene; ethane-1,2-diol; hexanedioic acid
SYSTEMATIC NAME: 1,3-diisocyanato-2-methyl-benzene; ethane-1,2-diol; hexanedioic acid
MOLECULAR FORMULA: C17H22N2O8
MOLECULAR WEIGHT: 382.36518
SMILES: CC1=C(C=CC=C1N=C=O)N=C=O.C(CCC(=O)O)CC(=O)O.C(CO)O
Structure:

CAS RN: 64927-22-6
CAS Name: 1,3-diisocyanato-2-methylbenzene; ethane-1,2-diol; hexanedioic acid
OPENEYE Name: adipic acid; 1,3-diisocyanato-2-methyl-benzene; ethylene glycol
IUPAC Name: 1,3-diisocyanato-2-methylbenzene; ethane-1,2-diol; hexanedioic acid
SYSTEMATIC NAME: 1,3-diisocyanato-2-methyl-benzene; ethane-1,2-diol; hexanedioic acid
MOLECULAR FORMULA: C17H22N2O8
MOLECULAR WEIGHT: 382.36518
SMILES: CC1=C(C=CC=C1N=C=O)N=C=O.C(CCC(=O)O)CC(=O)O.C(CO)O
Structure:

CAS RN: 64972-64-1
CAS Name: 1,3-diisocyanato-2-methylbenzene; ethane-1,2-diol; hexanedioic acid
OPENEYE Name: adipic acid; 1,3-diisocyanato-2-methyl-benzene; ethylene glycol
IUPAC Name: 1,3-diisocyanato-2-methylbenzene; ethane-1,2-diol; hexanedioic acid
SYSTEMATIC NAME: 1,3-diisocyanato-2-methyl-benzene; ethane-1,2-diol; hexanedioic acid
MOLECULAR FORMULA: C17H22N2O8
MOLECULAR WEIGHT: 382.36518
SMILES: CC1=C(C=CC=C1N=C=O)N=C=O.C(CCC(=O)O)CC(=O)O.C(CO)O
Structure:

CAS RN: 9019-92-5
CAS Name: 1,3-diisocyanato-2-methylbenzene; ethane-1,2-diol; hexanedioic acid
OPENEYE Name: adipic acid; 1,3-diisocyanato-2-methyl-benzene; ethylene glycol
IUPAC Name: 1,3-diisocyanato-2-methylbenzene; ethane-1,2-diol; hexanedioic acid
SYSTEMATIC NAME: 1,3-diisocyanato-2-methyl-benzene; ethane-1,2-diol; hexanedioic acid
MOLECULAR FORMULA: C17H22N2O8
MOLECULAR WEIGHT: 382.36518
SMILES: CC1=C(C=CC=C1N=C=O)N=C=O.C(CCC(=O)O)CC(=O)O.C(CO)O
Structure:

CAS RN: 39363-79-6
CAS Name: formaldehyde; 4-(4-hydroxyphenyl)sulfonylphenol; 1-naphthalenesulfonic acid
OPENEYE Name: formaldehyde; 4-(4-hydroxyphenyl)sulfonylphenol; naphthalene-1-sulfonic acid
IUPAC Name: formaldehyde; 4-(4-hydroxyphenyl)sulfonylphenol; naphthalene-1-sulfonic acid
SYSTEMATIC NAME: 4-(4-hydroxyphenyl)sulfonylphenol; methanal; naphthalene-1-sulfonic acid
MOLECULAR FORMULA: C23H20O8S2
MOLECULAR WEIGHT: 488.5301
SMILES: C=O.C1=CC=C2C(=C1)C=CC=C2S(=O)(=O)O.C1=CC(=CC=C1O)S(=O)(=O)C2=CC=C(C=C2)O
Structure:

CAS RN: 29590-42-9
CAS Name: 2-propenoic acid 6-methylheptyl ester
OPENEYE Name: 6-methylheptyl prop-2-enoate
IUPAC Name: 6-methylheptyl prop-2-enoate
SYSTEMATIC NAME: 6-methylheptyl prop-2-enoate
MOLECULAR FORMULA: C11H20O2
MOLECULAR WEIGHT: 184.2753
SMILES: CC(C)CCCCCOC(=O)C=C
Structure:

CAS RN: 178157-25-0
CAS Name: 1,2-bis(ethenyl)benzene; 4-ethenylpyridine
OPENEYE Name: 1,2-divinylbenzene; 4-vinylpyridine
IUPAC Name: 1,2-bis(ethenyl)benzene; 4-ethenylpyridine
SYSTEMATIC NAME: 1,2-bis(ethenyl)benzene; 4-ethenylpyridine
MOLECULAR FORMULA: C17H17N
MOLECULAR WEIGHT: 235.32358
SMILES: C=CC1=CC=NC=C1.C=CC1=CC=CC=C1C=C
Structure:

CAS RN: 111019-00-2
CAS Name: 1-ethenyl-2-methylbenzene; 1-methylethenylbenzene
OPENEYE Name: isopropenylbenzene; 1-methyl-2-vinyl-benzene
IUPAC Name: 1-ethenyl-2-methylbenzene; prop-1-en-2-ylbenzene
SYSTEMATIC NAME: 1-ethenyl-2-methyl-benzene; prop-1-en-2-ylbenzene
MOLECULAR FORMULA: C18H20
MOLECULAR WEIGHT: 236.3514
SMILES: CC1=CC=CC=C1C=C.CC(=C)C1=CC=CC=C1
Structure:

CAS RN: 113063-68-6
CAS Name: 1-ethenyl-2-methylbenzene; 1-methylethenylbenzene
OPENEYE Name: isopropenylbenzene; 1-methyl-2-vinyl-benzene
IUPAC Name: 1-ethenyl-2-methylbenzene; prop-1-en-2-ylbenzene
SYSTEMATIC NAME: 1-ethenyl-2-methyl-benzene; prop-1-en-2-ylbenzene
MOLECULAR FORMULA: C18H20
MOLECULAR WEIGHT: 236.3514
SMILES: CC1=CC=CC=C1C=C.CC(=C)C1=CC=CC=C1
Structure:

CAS RN: 37199-54-5
CAS Name: 1-ethenyl-2-methylbenzene; 1-methylethenylbenzene
OPENEYE Name: isopropenylbenzene; 1-methyl-2-vinyl-benzene
IUPAC Name: 1-ethenyl-2-methylbenzene; prop-1-en-2-ylbenzene
SYSTEMATIC NAME: 1-ethenyl-2-methyl-benzene; prop-1-en-2-ylbenzene
MOLECULAR FORMULA: C18H20
MOLECULAR WEIGHT: 236.3514
SMILES: CC1=CC=CC=C1C=C.CC(=C)C1=CC=CC=C1
Structure:

CAS RN: 39420-70-7
CAS Name: 1-ethenyl-2-methylbenzene; 1-methylethenylbenzene
OPENEYE Name: isopropenylbenzene; 1-methyl-2-vinyl-benzene
IUPAC Name: 1-ethenyl-2-methylbenzene; prop-1-en-2-ylbenzene
SYSTEMATIC NAME: 1-ethenyl-2-methyl-benzene; prop-1-en-2-ylbenzene
MOLECULAR FORMULA: C18H20
MOLECULAR WEIGHT: 236.3514
SMILES: CC1=CC=CC=C1C=C.CC(=C)C1=CC=CC=C1
Structure:

CAS RN: 53802-41-8
CAS Name: 1-ethenyl-2-methylbenzene; 1-methylethenylbenzene
OPENEYE Name: isopropenylbenzene; 1-methyl-2-vinyl-benzene
IUPAC Name: 1-ethenyl-2-methylbenzene; prop-1-en-2-ylbenzene
SYSTEMATIC NAME: 1-ethenyl-2-methyl-benzene; prop-1-en-2-ylbenzene
MOLECULAR FORMULA: C18H20
MOLECULAR WEIGHT: 236.3514
SMILES: CC1=CC=CC=C1C=C.CC(=C)C1=CC=CC=C1
Structure:

CAS RN: 68441-38-3
CAS Name: 1-ethenyl-2-methylbenzene; 1-methylethenylbenzene
OPENEYE Name: isopropenylbenzene; 1-methyl-2-vinyl-benzene
IUPAC Name: 1-ethenyl-2-methylbenzene; prop-1-en-2-ylbenzene
SYSTEMATIC NAME: 1-ethenyl-2-methyl-benzene; prop-1-en-2-ylbenzene
MOLECULAR FORMULA: C18H20
MOLECULAR WEIGHT: 236.3514
SMILES: CC1=CC=CC=C1C=C.CC(=C)C1=CC=CC=C1
Structure:

CAS RN: 133544-04-4
CAS Name: 1,3-diisocyanato-2-methylbenzene; 2-ethyl-2-(hydroxymethyl)propane-1,3-diol; hexanedioic acid; 2-(2-hydroxyethoxy)ethanol
OPENEYE Name: adipic acid; 1,3-diisocyanato-2-methyl-benzene; 2-ethyl-2-(hydroxymethyl)propane-1,3-diol; 2-(2-hydroxyethoxy)ethanol
IUPAC Name: 1,3-diisocyanato-2-methylbenzene; 2-ethyl-2-(hydroxymethyl)propane-1,3-diol; hexanedioic acid; 2-(2-hydroxyethoxy)ethanol
SYSTEMATIC NAME: 1,3-diisocyanato-2-methyl-benzene; 2-ethyl-2-(hydroxymethyl)propane-1,3-diol; hexanedioic acid; 2-(2-hydroxyethyloxy)ethanol
MOLECULAR FORMULA: C25H40N2O12
MOLECULAR WEIGHT: 560.5913
SMILES: CCC(CO)(CO)CO.CC1=C(C=CC=C1N=C=O)N=C=O.C(CCC(=O)O)CC(=O)O.C(COCCO)O
Structure:

CAS RN: 37208-77-8
CAS Name: 1,3-diisocyanato-2-methylbenzene; 2-ethyl-2-(hydroxymethyl)propane-1,3-diol; hexanedioic acid; 2-(2-hydroxyethoxy)ethanol
OPENEYE Name: adipic acid; 1,3-diisocyanato-2-methyl-benzene; 2-ethyl-2-(hydroxymethyl)propane-1,3-diol; 2-(2-hydroxyethoxy)ethanol
IUPAC Name: 1,3-diisocyanato-2-methylbenzene; 2-ethyl-2-(hydroxymethyl)propane-1,3-diol; hexanedioic acid; 2-(2-hydroxyethoxy)ethanol
SYSTEMATIC NAME: 1,3-diisocyanato-2-methyl-benzene; 2-ethyl-2-(hydroxymethyl)propane-1,3-diol; hexanedioic acid; 2-(2-hydroxyethyloxy)ethanol
MOLECULAR FORMULA: C25H40N2O12
MOLECULAR WEIGHT: 560.5913
SMILES: CCC(CO)(CO)CO.CC1=C(C=CC=C1N=C=O)N=C=O.C(CCC(=O)O)CC(=O)O.C(COCCO)O
Structure:

CAS RN: 50926-84-6
CAS Name: 1,3-diisocyanato-2-methylbenzene; 2-ethyl-2-(hydroxymethyl)propane-1,3-diol; hexanedioic acid; 2-(2-hydroxyethoxy)ethanol
OPENEYE Name: adipic acid; 1,3-diisocyanato-2-methyl-benzene; 2-ethyl-2-(hydroxymethyl)propane-1,3-diol; 2-(2-hydroxyethoxy)ethanol
IUPAC Name: 1,3-diisocyanato-2-methylbenzene; 2-ethyl-2-(hydroxymethyl)propane-1,3-diol; hexanedioic acid; 2-(2-hydroxyethoxy)ethanol
SYSTEMATIC NAME: 1,3-diisocyanato-2-methyl-benzene; 2-ethyl-2-(hydroxymethyl)propane-1,3-diol; hexanedioic acid; 2-(2-hydroxyethyloxy)ethanol
MOLECULAR FORMULA: C25H40N2O12
MOLECULAR WEIGHT: 560.5913
SMILES: CCC(CO)(CO)CO.CC1=C(C=CC=C1N=C=O)N=C=O.C(CCC(=O)O)CC(=O)O.C(COCCO)O
Structure:

CAS RN: 68212-32-8
CAS Name: 1,3-diisocyanato-2-methylbenzene; 2-ethyl-2-(hydroxymethyl)propane-1,3-diol; hexanedioic acid; 2-(2-hydroxyethoxy)ethanol
OPENEYE Name: adipic acid; 1,3-diisocyanato-2-methyl-benzene; 2-ethyl-2-(hydroxymethyl)propane-1,3-diol; 2-(2-hydroxyethoxy)ethanol
IUPAC Name: 1,3-diisocyanato-2-methylbenzene; 2-ethyl-2-(hydroxymethyl)propane-1,3-diol; hexanedioic acid; 2-(2-hydroxyethoxy)ethanol
SYSTEMATIC NAME: 1,3-diisocyanato-2-methyl-benzene; 2-ethyl-2-(hydroxymethyl)propane-1,3-diol; hexanedioic acid; 2-(2-hydroxyethyloxy)ethanol
MOLECULAR FORMULA: C25H40N2O12
MOLECULAR WEIGHT: 560.5913
SMILES: CCC(CO)(CO)CO.CC1=C(C=CC=C1N=C=O)N=C=O.C(CCC(=O)O)CC(=O)O.C(COCCO)O
Structure:

CAS RN: 85646-06-6
CAS Name: 1,3-diisocyanato-2-methylbenzene; 2-ethyl-2-(hydroxymethyl)propane-1,3-diol; hexanedioic acid; 2-(2-hydroxyethoxy)ethanol
OPENEYE Name: adipic acid; 1,3-diisocyanato-2-methyl-benzene; 2-ethyl-2-(hydroxymethyl)propane-1,3-diol; 2-(2-hydroxyethoxy)ethanol
IUPAC Name: 1,3-diisocyanato-2-methylbenzene; 2-ethyl-2-(hydroxymethyl)propane-1,3-diol; hexanedioic acid; 2-(2-hydroxyethoxy)ethanol
SYSTEMATIC NAME: 1,3-diisocyanato-2-methyl-benzene; 2-ethyl-2-(hydroxymethyl)propane-1,3-diol; hexanedioic acid; 2-(2-hydroxyethyloxy)ethanol
MOLECULAR FORMULA: C25H40N2O12
MOLECULAR WEIGHT: 560.5913
SMILES: CCC(CO)(CO)CO.CC1=C(C=CC=C1N=C=O)N=C=O.C(CCC(=O)O)CC(=O)O.C(COCCO)O
Structure:

CAS RN: 9017-16-7
CAS Name: 1,3-diisocyanato-2-methylbenzene; 2-ethyl-2-(hydroxymethyl)propane-1,3-diol; hexanedioic acid; 2-(2-hydroxyethoxy)ethanol
OPENEYE Name: adipic acid; 1,3-diisocyanato-2-methyl-benzene; 2-ethyl-2-(hydroxymethyl)propane-1,3-diol; 2-(2-hydroxyethoxy)ethanol
IUPAC Name: 1,3-diisocyanato-2-methylbenzene; 2-ethyl-2-(hydroxymethyl)propane-1,3-diol; hexanedioic acid; 2-(2-hydroxyethoxy)ethanol
SYSTEMATIC NAME: 1,3-diisocyanato-2-methyl-benzene; 2-ethyl-2-(hydroxymethyl)propane-1,3-diol; hexanedioic acid; 2-(2-hydroxyethyloxy)ethanol
MOLECULAR FORMULA: C25H40N2O12
MOLECULAR WEIGHT: 560.5913
SMILES: CCC(CO)(CO)CO.CC1=C(C=CC=C1N=C=O)N=C=O.C(CCC(=O)O)CC(=O)O.C(COCCO)O
Structure:

CAS RN: 167856-49-7
CAS Name: 1,3-diisocyanato-2-methylbenzene; hexanedioic acid; 2-(2-hydroxyethoxy)ethanol
OPENEYE Name: adipic acid; 1,3-diisocyanato-2-methyl-benzene; 2-(2-hydroxyethoxy)ethanol
IUPAC Name: 1,3-diisocyanato-2-methylbenzene; hexanedioic acid; 2-(2-hydroxyethoxy)ethanol
SYSTEMATIC NAME: 1,3-diisocyanato-2-methyl-benzene; hexanedioic acid; 2-(2-hydroxyethyloxy)ethanol
MOLECULAR FORMULA: C19H26N2O9
MOLECULAR WEIGHT: 426.41774
SMILES: CC1=C(C=CC=C1N=C=O)N=C=O.C(CCC(=O)O)CC(=O)O.C(COCCO)O
Structure:

CAS RN: 206872-26-6
CAS Name: 1,3-diisocyanato-2-methylbenzene; hexanedioic acid; 2-(2-hydroxyethoxy)ethanol
OPENEYE Name: adipic acid; 1,3-diisocyanato-2-methyl-benzene; 2-(2-hydroxyethoxy)ethanol
IUPAC Name: 1,3-diisocyanato-2-methylbenzene; hexanedioic acid; 2-(2-hydroxyethoxy)ethanol
SYSTEMATIC NAME: 1,3-diisocyanato-2-methyl-benzene; hexanedioic acid; 2-(2-hydroxyethyloxy)ethanol
MOLECULAR FORMULA: C19H26N2O9
MOLECULAR WEIGHT: 426.41774
SMILES: CC1=C(C=CC=C1N=C=O)N=C=O.C(CCC(=O)O)CC(=O)O.C(COCCO)O
Structure:

CAS RN: 6422-99-7
CAS Name: decanedioic acid; hexane-1,6-diamine
OPENEYE Name: decanedioic acid; hexane-1,6-diamine
IUPAC Name: decanedioic acid; hexane-1,6-diamine
SYSTEMATIC NAME: decanedioic acid; hexane-1,6-diamine
MOLECULAR FORMULA: C16H34N2O4
MOLECULAR WEIGHT: 318.45216
SMILES: C(CCCCC(=O)O)CCCC(=O)O.C(CCCN)CCN
Structure:

CAS RN: 104492-15-1
CAS Name: 1-methylethenylbenzene; styrene
OPENEYE Name: isopropenylbenzene; styrene
IUPAC Name: prop-1-en-2-ylbenzene; styrene
SYSTEMATIC NAME: ethenylbenzene; prop-1-en-2-ylbenzene
MOLECULAR FORMULA: C17H18
MOLECULAR WEIGHT: 222.32482
SMILES: CC(=C)C1=CC=CC=C1.C=CC1=CC=CC=C1
Structure:

CAS RN: 148092-83-5
CAS Name: 1-methylethenylbenzene; styrene
OPENEYE Name: isopropenylbenzene; styrene
IUPAC Name: prop-1-en-2-ylbenzene; styrene
SYSTEMATIC NAME: ethenylbenzene; prop-1-en-2-ylbenzene
MOLECULAR FORMULA: C17H18
MOLECULAR WEIGHT: 222.32482
SMILES: CC(=C)C1=CC=CC=C1.C=CC1=CC=CC=C1
Structure:

CAS RN: 229497-69-2
CAS Name: 1-methylethenylbenzene; styrene
OPENEYE Name: isopropenylbenzene; styrene
IUPAC Name: prop-1-en-2-ylbenzene; styrene
SYSTEMATIC NAME: ethenylbenzene; prop-1-en-2-ylbenzene
MOLECULAR FORMULA: C17H18
MOLECULAR WEIGHT: 222.32482
SMILES: CC(=C)C1=CC=CC=C1.C=CC1=CC=CC=C1
Structure:

CAS RN: 68441-37-2
CAS Name: 1-methylethenylbenzene; styrene
OPENEYE Name: isopropenylbenzene; styrene
IUPAC Name: prop-1-en-2-ylbenzene; styrene
SYSTEMATIC NAME: ethenylbenzene; prop-1-en-2-ylbenzene
MOLECULAR FORMULA: C17H18
MOLECULAR WEIGHT: 222.32482
SMILES: CC(=C)C1=CC=CC=C1.C=CC1=CC=CC=C1
Structure:

CAS RN: 80112-04-5
CAS Name: 1-methylethenylbenzene; styrene
OPENEYE Name: isopropenylbenzene; styrene
IUPAC Name: prop-1-en-2-ylbenzene; styrene
SYSTEMATIC NAME: ethenylbenzene; prop-1-en-2-ylbenzene
MOLECULAR FORMULA: C17H18
MOLECULAR WEIGHT: 222.32482
SMILES: CC(=C)C1=CC=CC=C1.C=CC1=CC=CC=C1
Structure:

CAS RN: 83855-53-2
CAS Name: 1-methylethenylbenzene; 2-propenenitrile; styrene
OPENEYE Name: isopropenylbenzene; prop-2-enenitrile; styrene
IUPAC Name: prop-2-enenitrile; prop-1-en-2-ylbenzene; styrene
SYSTEMATIC NAME: ethenylbenzene; prop-2-enenitrile; prop-1-en-2-ylbenzene
MOLECULAR FORMULA: C20H21N
MOLECULAR WEIGHT: 275.38744
SMILES: CC(=C)C1=CC=CC=C1.C=CC#N.C=CC1=CC=CC=C1
Structure:

CAS RN: 50809-61-5
CAS Name: buta-1,3-diene; 2-methyl-2-propenoic acid methyl ester; 2-propenenitrile; styrene
OPENEYE Name: buta-1,3-diene; methyl 2-methylprop-2-enoate; prop-2-enenitrile; styrene
IUPAC Name: buta-1,3-diene; methyl 2-methylprop-2-enoate; prop-2-enenitrile; styrene
SYSTEMATIC NAME: buta-1,3-diene; ethenylbenzene; methyl 2-methylprop-2-enoate; prop-2-enenitrile
MOLECULAR FORMULA: C20H25NO2
MOLECULAR WEIGHT: 311.418
SMILES: CC(=C)C(=O)OC.C=CC=C.C=CC#N.C=CC1=CC=CC=C1
Structure:

CAS RN: 59948-50-4
CAS Name: buta-1,3-diene; 2-methyl-2-propenoic acid methyl ester; 2-propenenitrile; styrene
OPENEYE Name: buta-1,3-diene; methyl 2-methylprop-2-enoate; prop-2-enenitrile; styrene
IUPAC Name: buta-1,3-diene; methyl 2-methylprop-2-enoate; prop-2-enenitrile; styrene
SYSTEMATIC NAME: buta-1,3-diene; ethenylbenzene; methyl 2-methylprop-2-enoate; prop-2-enenitrile
MOLECULAR FORMULA: C20H25NO2
MOLECULAR WEIGHT: 311.418
SMILES: CC(=C)C(=O)OC.C=CC=C.C=CC#N.C=CC1=CC=CC=C1
Structure:

CAS RN: 66038-86-6
CAS Name: buta-1,3-diene; 2-methyl-2-propenoic acid methyl ester; 2-propenenitrile; styrene
OPENEYE Name: buta-1,3-diene; methyl 2-methylprop-2-enoate; prop-2-enenitrile; styrene
IUPAC Name: buta-1,3-diene; methyl 2-methylprop-2-enoate; prop-2-enenitrile; styrene
SYSTEMATIC NAME: buta-1,3-diene; ethenylbenzene; methyl 2-methylprop-2-enoate; prop-2-enenitrile
MOLECULAR FORMULA: C20H25NO2
MOLECULAR WEIGHT: 311.418
SMILES: CC(=C)C(=O)OC.C=CC=C.C=CC#N.C=CC1=CC=CC=C1
Structure:

CAS RN: 177151-11-0
CAS Name: buta-1,3-diene; 2-methyl-2-propenoic acid; styrene
OPENEYE Name: buta-1,3-diene; 2-methylprop-2-enoic acid; styrene
IUPAC Name: buta-1,3-diene; 2-methylprop-2-enoic acid; styrene
SYSTEMATIC NAME: buta-1,3-diene; ethenylbenzene; 2-methylprop-2-enoic acid
MOLECULAR FORMULA: C16H20O2
MOLECULAR WEIGHT: 244.3288
SMILES: CC(=C)C(=O)O.C=CC=C.C=CC1=CC=CC=C1
Structure:

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