CAS RN: 26428-43-3
CAS Name: 2-methylenehexanoic acid; 2-methyl-2-propenoic acid 2-oxiranylmethyl ester; styrene
OPENEYE Name: 2-methylenehexanoic acid; oxiran-2-ylmethyl 2-methylprop-2-enoate; styrene
IUPAC Name: 2-methylidenehexanoic acid; oxiran-2-ylmethyl 2-methylprop-2-enoate; styrene
SYSTEMATIC NAME: ethenylbenzene; 2-methylidenehexanoic acid; oxiran-2-ylmethyl 2-methylprop-2-enoate
MOLECULAR FORMULA: C22H30O5
MOLECULAR WEIGHT: 374.4706
SMILES: CCCCC(=C)C(=O)O.CC(=C)C(=O)OCC1CO1.C=CC1=CC=CC=C1
Structure:
CAS RN: 26427-29-2
CAS Name: [(2R,3S,4R,5R)-5-(4-amino-2-oxo-1-pyrimidinyl)-3,4-dihydroxy-2-oxolanyl]methyl dihydrogen phosphate; [(2R,3S,4R,5R)-5-(2,4-dioxo-1-pyrimidinyl)-3,4-dihydroxy-2-oxolanyl]methyl dihydrogen phosphate
OPENEYE Name: [(2R,3S,4R,5R)-5-(4-amino-2-oxo-pyrimidin-1-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl dihydrogen phosphate; [(2R,3S,4R,5R)-5-(2,4-dioxopyrimidin-1-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl dihydrogen phosphate
IUPAC Name: [(2R,3S,4R,5R)-5-(4-amino-2-oxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl dihydrogen phosphate; [(2R,3S,4R,5R)-5-(2,4-dioxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl dihydrogen phosphate
SYSTEMATIC NAME: [(2R,3S,4R,5R)-5-(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methyl dihydrogen phosphate; [(2R,3S,4R,5R)-5-[2,4-bis(oxidanylidene)pyrimidin-1-yl]-3,4-bis(oxidanyl)oxolan-2-yl]methyl dihydrogen phosphate
MOLECULAR FORMULA: C18H27N5O17P2
MOLECULAR WEIGHT: 647.377802
SMILES: C1=CN(C(=O)N=C1N)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)O)O)O.C1=CN(C(=O)NC1=O)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)O)O)O
Structure:
CAS RN: 128000-11-3
CAS Name: 1,6-diisocyanatohexane; 2,4-diisocyanato-1-methylbenzene
OPENEYE Name: 1,6-diisocyanatohexane; 2,4-diisocyanato-1-methyl-benzene
IUPAC Name: 1,6-diisocyanatohexane; 2,4-diisocyanato-1-methylbenzene
SYSTEMATIC NAME: 1,6-diisocyanatohexane; 2,4-diisocyanato-1-methyl-benzene
MOLECULAR FORMULA: C17H18N4O4
MOLECULAR WEIGHT: 342.34922
SMILES: CC1=C(C=C(C=C1)N=C=O)N=C=O.C(CCCN=C=O)CCN=C=O
Structure:
CAS RN: 26412-87-3
CAS Name: pyridine; sulfur trioxide
OPENEYE Name: pyridine; sulfur trioxide
IUPAC Name: pyridine; sulfur trioxide
SYSTEMATIC NAME: pyridine; sulfur trioxide
MOLECULAR FORMULA: C5H5NO3S
MOLECULAR WEIGHT: 159.1631
SMILES: C1=CC=NC=C1.O=S(=O)=O
Structure:
CAS RN: 28322-92-1
CAS Name: pyridine; sulfur trioxide
OPENEYE Name: pyridine; sulfur trioxide
IUPAC Name: pyridine; sulfur trioxide
SYSTEMATIC NAME: pyridine; sulfur trioxide
MOLECULAR FORMULA: C5H5NO3S
MOLECULAR WEIGHT: 159.1631
SMILES: C1=CC=NC=C1.O=S(=O)=O
Structure:
CAS RN: 26403-62-3
CAS Name: octadecanoic acid 3-(1-oxooctadecoxy)propyl ester
OPENEYE Name: 3-octadecanoyloxypropyl octadecanoate
IUPAC Name: 3-octadecanoyloxypropyl octadecanoate
SYSTEMATIC NAME: 3-octadecanoyloxypropyl octadecanoate
MOLECULAR FORMULA: C39H76O4
MOLECULAR WEIGHT: 609.01834
SMILES: CCCCCCCCCCCCCCCCCC(=O)OCCCOC(=O)CCCCCCCCCCCCCCCCC
Structure:
CAS RN: 354118-39-1
CAS Name: octadecanoic acid 3-(1-oxooctadecoxy)propyl ester
OPENEYE Name: 3-octadecanoyloxypropyl octadecanoate
IUPAC Name: 3-octadecanoyloxypropyl octadecanoate
SYSTEMATIC NAME: 3-octadecanoyloxypropyl octadecanoate
MOLECULAR FORMULA: C39H76O4
MOLECULAR WEIGHT: 609.01834
SMILES: CCCCCCCCCCCCCCCCCC(=O)OCCCOC(=O)CCCCCCCCCCCCCCCCC
Structure:
CAS RN: 11139-91-6
CAS Name: hexanoic acid; propane-1,2,3-triol
OPENEYE Name: glycerol; hexanoic acid
IUPAC Name: hexanoic acid; propane-1,2,3-triol
SYSTEMATIC NAME: hexanoic acid; propane-1,2,3-triol
MOLECULAR FORMULA: C9H20O5
MOLECULAR WEIGHT: 208.2521
SMILES: CCCCCC(=O)O.C(C(CO)O)O
Structure:
CAS RN: 26375-31-5
CAS Name: acetic acid ethenyl ester; ethene; 2-methyl-2-propenoic acid
OPENEYE Name: ethylene; 2-methylprop-2-enoic acid; vinyl acetate
IUPAC Name: ethene; ethenyl acetate; 2-methylprop-2-enoic acid
SYSTEMATIC NAME: ethene; ethenyl ethanoate; 2-methylprop-2-enoic acid
MOLECULAR FORMULA: C10H16O4
MOLECULAR WEIGHT: 200.23164
SMILES: CC(=C)C(=O)O.CC(=O)OC=C.C=C
Structure:
CAS RN: 37348-55-3
CAS Name: acetic acid ethenyl ester; ethene; 2-methyl-2-propenoic acid
OPENEYE Name: ethylene; 2-methylprop-2-enoic acid; vinyl acetate
IUPAC Name: ethene; ethenyl acetate; 2-methylprop-2-enoic acid
SYSTEMATIC NAME: ethene; ethenyl ethanoate; 2-methylprop-2-enoic acid
MOLECULAR FORMULA: C10H16O4
MOLECULAR WEIGHT: 200.23164
SMILES: CC(=C)C(=O)O.CC(=O)OC=C.C=C
Structure:
CAS RN: 26355-78-2
CAS Name: ethene; 2-propenoic acid; 2-propenoic acid butyl ester
OPENEYE Name: acrylic acid; butyl prop-2-enoate; ethylene
IUPAC Name: butyl prop-2-enoate; ethene; prop-2-enoic acid
SYSTEMATIC NAME: butyl prop-2-enoate; ethene; prop-2-enoic acid
MOLECULAR FORMULA: C12H20O4
MOLECULAR WEIGHT: 228.2848
SMILES: CCCCOC(=O)C=C.C=C.C=CC(=O)O
Structure:
CAS RN: 26354-30-3
CAS Name: acetic acid ethenyl ester; dodecanoic acid ethenyl ester
OPENEYE Name: vinyl acetate; vinyl dodecanoate
IUPAC Name: ethenyl acetate; ethenyl dodecanoate
SYSTEMATIC NAME: ethenyl dodecanoate; ethenyl ethanoate
MOLECULAR FORMULA: C18H32O4
MOLECULAR WEIGHT: 312.44428
SMILES: CCCCCCCCCCCC(=O)OC=C.CC(=O)OC=C
Structure:
CAS RN: 66565-72-8
CAS Name: acetic acid ethenyl ester; dodecanoic acid ethenyl ester
OPENEYE Name: vinyl acetate; vinyl dodecanoate
IUPAC Name: ethenyl acetate; ethenyl dodecanoate
SYSTEMATIC NAME: ethenyl dodecanoate; ethenyl ethanoate
MOLECULAR FORMULA: C18H32O4
MOLECULAR WEIGHT: 312.44428
SMILES: CCCCCCCCCCCC(=O)OC=C.CC(=O)OC=C
Structure:
CAS RN: 113496-36-9
CAS Name: formaldehyde; 2-naphthalenesulfonic acid
OPENEYE Name: formaldehyde; naphthalene-2-sulfonic acid
IUPAC Name: formaldehyde; naphthalene-2-sulfonic acid
SYSTEMATIC NAME: methanal; naphthalene-2-sulfonic acid
MOLECULAR FORMULA: C11H10O4S
MOLECULAR WEIGHT: 238.2597
SMILES: C=O.C1=CC=C2C=C(C=CC2=C1)S(=O)(=O)O
Structure:
CAS RN: 130299-35-3
CAS Name: formaldehyde; 2-naphthalenesulfonic acid
OPENEYE Name: formaldehyde; naphthalene-2-sulfonic acid
IUPAC Name: formaldehyde; naphthalene-2-sulfonic acid
SYSTEMATIC NAME: methanal; naphthalene-2-sulfonic acid
MOLECULAR FORMULA: C11H10O4S
MOLECULAR WEIGHT: 238.2597
SMILES: C=O.C1=CC=C2C=C(C=CC2=C1)S(=O)(=O)O
Structure:
CAS RN: 26353-67-3
CAS Name: formaldehyde; 2-naphthalenesulfonic acid
OPENEYE Name: formaldehyde; naphthalene-2-sulfonic acid
IUPAC Name: formaldehyde; naphthalene-2-sulfonic acid
SYSTEMATIC NAME: methanal; naphthalene-2-sulfonic acid
MOLECULAR FORMULA: C11H10O4S
MOLECULAR WEIGHT: 238.2597
SMILES: C=O.C1=CC=C2C=C(C=CC2=C1)S(=O)(=O)O
Structure:
CAS RN: 52907-28-5
CAS Name: formaldehyde; 2-naphthalenesulfonic acid
OPENEYE Name: formaldehyde; naphthalene-2-sulfonic acid
IUPAC Name: formaldehyde; naphthalene-2-sulfonic acid
SYSTEMATIC NAME: methanal; naphthalene-2-sulfonic acid
MOLECULAR FORMULA: C11H10O4S
MOLECULAR WEIGHT: 238.2597
SMILES: C=O.C1=CC=C2C=C(C=CC2=C1)S(=O)(=O)O
Structure:
CAS RN: 26353-42-4
CAS Name: 2-propenoic acid butyl ester; 2-propenoic acid ethyl ester
OPENEYE Name: butyl prop-2-enoate; ethyl prop-2-enoate
IUPAC Name: butyl prop-2-enoate; ethyl prop-2-enoate
SYSTEMATIC NAME: butyl prop-2-enoate; ethyl prop-2-enoate
MOLECULAR FORMULA: C12H20O4
MOLECULAR WEIGHT: 228.2848
SMILES: CCCCOC(=O)C=C.CCOC(=O)C=C
Structure:
CAS RN: 37297-32-8
CAS Name: 2-propenoic acid butyl ester; 2-propenoic acid ethyl ester
OPENEYE Name: butyl prop-2-enoate; ethyl prop-2-enoate
IUPAC Name: butyl prop-2-enoate; ethyl prop-2-enoate
SYSTEMATIC NAME: butyl prop-2-enoate; ethyl prop-2-enoate
MOLECULAR FORMULA: C12H20O4
MOLECULAR WEIGHT: 228.2848
SMILES: CCCCOC(=O)C=C.CCOC(=O)C=C
Structure:
CAS RN: 26351-99-5
CAS Name: 2-methylenehexanoate; 2-methyl-2-propenoic acid 2-hydroxyethyl ester; 2-methyl-2-propenoic acid methyl ester; 2-propenoic acid
OPENEYE Name: acrylic acid; 2-hydroxyethyl 2-methylprop-2-enoate; 2-methylenehexanoate; methyl 2-methylprop-2-enoate
IUPAC Name: 2-hydroxyethyl 2-methylprop-2-enoate; 2-methylidenehexanoate; methyl 2-methylprop-2-enoate; prop-2-enoic acid
SYSTEMATIC NAME: 2-hydroxyethyl 2-methylprop-2-enoate; 2-methylidenehexanoate; methyl 2-methylprop-2-enoate; prop-2-enoic acid
MOLECULAR FORMULA: C21H33O9-
MOLECULAR WEIGHT: 429.48132
SMILES: CCCCC(=C)C(=O)[O-].CC(=C)C(=O)OC.CC(=C)C(=O)OCCO.C=CC(=O)O
Structure:
CAS RN: 3183-41-3
CAS Name: buta-1,3-diene; 1,1-dichloroethene
OPENEYE Name: buta-1,3-diene; 1,1-dichloroethylene
IUPAC Name: buta-1,3-diene; 1,1-dichloroethene
SYSTEMATIC NAME: 1,1-bis(chloranyl)ethene; buta-1,3-diene
MOLECULAR FORMULA: C6H8Cl2
MOLECULAR WEIGHT: 151.03372
SMILES: C=CC=C.C=C(Cl)Cl
Structure:
CAS RN: 132433-87-5
CAS Name: acetic acid ethenyl ester; ethene; methanone
OPENEYE Name: ethylene; methanone; vinyl acetate
IUPAC Name: ethene; ethenyl acetate; methanone
SYSTEMATIC NAME: ethene; ethenyl ethanoate; methanone
MOLECULAR FORMULA: C7H10O3
MOLECULAR WEIGHT: 142.1525
SMILES: CC(=O)OC=C.C=C.[C]=O
Structure:
CAS RN: 26337-35-9
CAS Name: acetic acid ethenyl ester; ethene; methanone
OPENEYE Name: ethylene; methanone; vinyl acetate
IUPAC Name: ethene; ethenyl acetate; methanone
SYSTEMATIC NAME: ethene; ethenyl ethanoate; methanone
MOLECULAR FORMULA: C7H10O3
MOLECULAR WEIGHT: 142.1525
SMILES: CC(=O)OC=C.C=C.[C]=O
Structure:
CAS RN: 63551-89-3
CAS Name: acetic acid ethenyl ester; ethene; methanone
OPENEYE Name: ethylene; methanone; vinyl acetate
IUPAC Name: ethene; ethenyl acetate; methanone
SYSTEMATIC NAME: ethene; ethenyl ethanoate; methanone
MOLECULAR FORMULA: C7H10O3
MOLECULAR WEIGHT: 142.1525
SMILES: CC(=O)OC=C.C=C.[C]=O
Structure:
CAS RN: 74506-23-3
CAS Name: acetic acid ethenyl ester; ethene; methanone
OPENEYE Name: ethylene; methanone; vinyl acetate
IUPAC Name: ethene; ethenyl acetate; methanone
SYSTEMATIC NAME: ethene; ethenyl ethanoate; methanone
MOLECULAR FORMULA: C7H10O3
MOLECULAR WEIGHT: 142.1525
SMILES: CC(=O)OC=C.C=C.[C]=O
Structure:
CAS RN: 131873-52-4
CAS Name: benzene-1,3-dicarboxylic acid; furan-2,5-dione; propane-1,2-diol
OPENEYE Name: furan-2,5-dione; isophthalic acid; propane-1,2-diol
IUPAC Name: benzene-1,3-dicarboxylic acid; furan-2,5-dione; propane-1,2-diol
SYSTEMATIC NAME: benzene-1,3-dicarboxylic acid; furan-2,5-dione; propane-1,2-diol
MOLECULAR FORMULA: C15H16O9
MOLECULAR WEIGHT: 340.28214
SMILES: CC(CO)O.C1=CC(=CC(=C1)C(=O)O)C(=O)O.C1=CC(=O)OC1=O
Structure:
CAS RN: 167678-98-0
CAS Name: benzene-1,3-dicarboxylic acid; furan-2,5-dione; propane-1,2-diol
OPENEYE Name: furan-2,5-dione; isophthalic acid; propane-1,2-diol
IUPAC Name: benzene-1,3-dicarboxylic acid; furan-2,5-dione; propane-1,2-diol
SYSTEMATIC NAME: benzene-1,3-dicarboxylic acid; furan-2,5-dione; propane-1,2-diol
MOLECULAR FORMULA: C15H16O9
MOLECULAR WEIGHT: 340.28214
SMILES: CC(CO)O.C1=CC(=CC(=C1)C(=O)O)C(=O)O.C1=CC(=O)OC1=O
Structure:
CAS RN: 194100-48-6
CAS Name: benzene-1,3-dicarboxylic acid; furan-2,5-dione; propane-1,2-diol
OPENEYE Name: furan-2,5-dione; isophthalic acid; propane-1,2-diol
IUPAC Name: benzene-1,3-dicarboxylic acid; furan-2,5-dione; propane-1,2-diol
SYSTEMATIC NAME: benzene-1,3-dicarboxylic acid; furan-2,5-dione; propane-1,2-diol
MOLECULAR FORMULA: C15H16O9
MOLECULAR WEIGHT: 340.28214
SMILES: CC(CO)O.C1=CC(=CC(=C1)C(=O)O)C(=O)O.C1=CC(=O)OC1=O
Structure:
CAS RN: 26301-26-8
CAS Name: benzene-1,3-dicarboxylic acid; furan-2,5-dione; propane-1,2-diol
OPENEYE Name: furan-2,5-dione; isophthalic acid; propane-1,2-diol
IUPAC Name: benzene-1,3-dicarboxylic acid; furan-2,5-dione; propane-1,2-diol
SYSTEMATIC NAME: benzene-1,3-dicarboxylic acid; furan-2,5-dione; propane-1,2-diol
MOLECULAR FORMULA: C15H16O9
MOLECULAR WEIGHT: 340.28214
SMILES: CC(CO)O.C1=CC(=CC(=C1)C(=O)O)C(=O)O.C1=CC(=O)OC1=O
Structure:
CAS RN: 438496-31-2
CAS Name: benzene-1,3-dicarboxylic acid; furan-2,5-dione; propane-1,2-diol
OPENEYE Name: furan-2,5-dione; isophthalic acid; propane-1,2-diol
IUPAC Name: benzene-1,3-dicarboxylic acid; furan-2,5-dione; propane-1,2-diol
SYSTEMATIC NAME: benzene-1,3-dicarboxylic acid; furan-2,5-dione; propane-1,2-diol
MOLECULAR FORMULA: C15H16O9
MOLECULAR WEIGHT: 340.28214
SMILES: CC(CO)O.C1=CC(=CC(=C1)C(=O)O)C(=O)O.C1=CC(=O)OC1=O
Structure:
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