Wednesday, October 24, 2012

http://ChemLookup.com Compounds




CAS RN: 67828-65-3
CAS Name: zinc 3-chloro-4-(4-morpholinyl)benzenediazonium tetrachloride
OPENEYE Name: zinc 3-chloro-4-morpholino-benzenediazonium tetrachloride
IUPAC Name: zinc 3-chloro-4-morpholin-4-ylbenzenediazonium tetrachloride
SYSTEMATIC NAME: zinc 3-chloranyl-4-morpholin-4-yl-benzenediazonium tetrachloride
MOLECULAR FORMULA: C20H22Cl6N6O2Zn
MOLECULAR WEIGHT: 656.55468
SMILES: C1COCCN1C2=C(C=C(C=C2)[N+]#N)Cl.C1COCCN1C2=C(C=C(C=C2)[N+]#N)Cl.[Cl-].[Cl-].[Cl-].[Cl-].[Zn+2]
Structure:

CAS RN: 67828-12-0
CAS Name: acetic acid ethenyl ester; 8-methylnonanoic acid ethenyl ester; 2-propenoic acid butyl ester
OPENEYE Name: butyl prop-2-enoate; vinyl acetate; vinyl 8-methylnonanoate
IUPAC Name: butyl prop-2-enoate; ethenyl acetate; ethenyl 8-methylnonanoate
SYSTEMATIC NAME: butyl prop-2-enoate; ethenyl ethanoate; ethenyl 8-methylnonanoate
MOLECULAR FORMULA: C23H40O6
MOLECULAR WEIGHT: 412.5601
SMILES: CCCCOC(=O)C=C.CC(C)CCCCCCC(=O)OC=C.CC(=O)OC=C
Structure:

CAS RN: 67828-07-3
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C38H32CuN12O3
MOLECULAR WEIGHT: 768.28528
SMILES: C1=CC=C2C(=C1)C3=NC4=C5C=CC=C(C5=C([N-]4)N=C6C7=C(C=CC=C7CN)C(=N6)N=C8C9=C(C=CC(=C9C(=N8)N=C2[N-]3)CN)CN)CN.C(C(=O)O)O.[Cu+2]
Structure:

CAS RN: 67827-73-0
CAS Name: 2-methylenehexanoic acid; 2-methyl-2-propenoic acid octadecyl ester; 2-propenoic acid methyl ester
OPENEYE Name: 2-methylenehexanoic acid; methyl prop-2-enoate; octadecyl 2-methylprop-2-enoate
IUPAC Name: 2-methylidenehexanoic acid; methyl prop-2-enoate; octadecyl 2-methylprop-2-enoate
SYSTEMATIC NAME: 2-methylidenehexanoic acid; methyl prop-2-enoate; octadecyl 2-methylprop-2-enoate
MOLECULAR FORMULA: C33H60O6
MOLECULAR WEIGHT: 552.8259
SMILES: CCCCCCCCCCCCCCCCCCOC(=O)C(=C)C.CCCCC(=C)C(=O)O.COC(=O)C=C
Structure:

CAS RN: 130651-40-0
CAS Name: 2-ethylhexanoate; palladium(2+)
OPENEYE Name: 2-ethylhexanoate; palladium(2+)
IUPAC Name: 2-ethylhexanoate; palladium(2+)
SYSTEMATIC NAME: 2-ethylhexanoate; palladium(2+)
MOLECULAR FORMULA: C16H30O4Pd
MOLECULAR WEIGHT: 392.827
SMILES: CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].[Pd+2]
Structure:

CAS RN: 146425-12-9
CAS Name: 2-ethylhexanoate; palladium(2+)
OPENEYE Name: 2-ethylhexanoate; palladium(2+)
IUPAC Name: 2-ethylhexanoate; palladium(2+)
SYSTEMATIC NAME: 2-ethylhexanoate; palladium(2+)
MOLECULAR FORMULA: C16H30O4Pd
MOLECULAR WEIGHT: 392.827
SMILES: CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].[Pd+2]
Structure:

CAS RN: 67816-11-9
CAS Name: 2-ethylhexanoate; palladium(2+)
OPENEYE Name: 2-ethylhexanoate; palladium(2+)
IUPAC Name: 2-ethylhexanoate; palladium(2+)
SYSTEMATIC NAME: 2-ethylhexanoate; palladium(2+)
MOLECULAR FORMULA: C16H30O4Pd
MOLECULAR WEIGHT: 392.827
SMILES: CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].[Pd+2]
Structure:

CAS RN: 103659-42-3
CAS Name: 2-ethylhexanoate; lanthanum(3+)
OPENEYE Name: 2-ethylhexanoate; lanthanum(3+)
IUPAC Name: 2-ethylhexanoate; lanthanum(3+)
SYSTEMATIC NAME: 2-ethylhexanoate; lanthanum(3+)
MOLECULAR FORMULA: C24H45LaO6
MOLECULAR WEIGHT: 568.516
SMILES: CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].[La+3]
Structure:

CAS RN: 158627-29-3
CAS Name: 2-ethylhexanoate; lanthanum(3+)
OPENEYE Name: 2-ethylhexanoate; lanthanum(3+)
IUPAC Name: 2-ethylhexanoate; lanthanum(3+)
SYSTEMATIC NAME: 2-ethylhexanoate; lanthanum(3+)
MOLECULAR FORMULA: C24H45LaO6
MOLECULAR WEIGHT: 568.516
SMILES: CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].[La+3]
Structure:

CAS RN: 67816-09-5
CAS Name: 2-ethylhexanoate; lanthanum(3+)
OPENEYE Name: 2-ethylhexanoate; lanthanum(3+)
IUPAC Name: 2-ethylhexanoate; lanthanum(3+)
SYSTEMATIC NAME: 2-ethylhexanoate; lanthanum(3+)
MOLECULAR FORMULA: C24H45LaO6
MOLECULAR WEIGHT: 568.516
SMILES: CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].[La+3]
Structure:

CAS RN: 67816-08-4
CAS Name: iridium(3+); octanoate
OPENEYE Name: iridium(3+); octanoate
IUPAC Name: iridium(3+); octanoate
SYSTEMATIC NAME: iridium(3+); octanoate
MOLECULAR FORMULA: C24H45IrO6
MOLECULAR WEIGHT: 621.8275
SMILES: CCCCCCCC(=O)[O-].CCCCCCCC(=O)[O-].CCCCCCCC(=O)[O-].[Ir+3]
Structure:

CAS RN: 67816-07-3
CAS Name: 2-ethylhexanoate; iridium(3+)
OPENEYE Name: 2-ethylhexanoate; iridium(3+)
IUPAC Name: 2-ethylhexanoate; iridium(3+)
SYSTEMATIC NAME: 2-ethylhexanoate; iridium(3+)
MOLECULAR FORMULA: C24H45IrO6
MOLECULAR WEIGHT: 621.8275
SMILES: CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].[Ir+3]
Structure:

CAS RN: 67816-06-2
CAS Name: 2-ethylhexanoate; indium(3+)
OPENEYE Name: 2-ethylhexanoate; indium(3+)
IUPAC Name: 2-ethylhexanoate; indium(3+)
SYSTEMATIC NAME: 2-ethylhexanoate; indium(3+)
MOLECULAR FORMULA: C24H45InO6
MOLECULAR WEIGHT: 544.4285
SMILES: CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].[In+3]
Structure:

CAS RN: 69375-27-5
CAS Name: 2-ethylhexanoate; indium(3+)
OPENEYE Name: 2-ethylhexanoate; indium(3+)
IUPAC Name: 2-ethylhexanoate; indium(3+)
SYSTEMATIC NAME: 2-ethylhexanoate; indium(3+)
MOLECULAR FORMULA: C24H45InO6
MOLECULAR WEIGHT: 544.4285
SMILES: CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].[In+3]
Structure:

CAS RN: 67816-05-1
CAS Name: 2-ethylhexanoate; ruthenium(3+)
OPENEYE Name: 2-ethylhexanoate; ruthenium(3+)
IUPAC Name: 2-ethylhexanoate; ruthenium(3+)
SYSTEMATIC NAME: 2-ethylhexanoate; ruthenium(3+)
MOLECULAR FORMULA: C24H45O6Ru
MOLECULAR WEIGHT: 530.6805
SMILES: CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].[Ru+3]
Structure:

CAS RN: 67815-99-0
CAS Name: 2-methyl-2-propenoic acid; 2-methyl-2-propenoic acid methyl ester; 2-propenoic acid; 2-propenoic acid butyl ester; 2-propenoic acid ethyl ester; styrene
OPENEYE Name: acrylic acid; butyl prop-2-enoate; ethyl prop-2-enoate; methyl 2-methylprop-2-enoate; 2-methylprop-2-enoic acid; styrene
IUPAC Name: butyl prop-2-enoate; ethyl prop-2-enoate; methyl 2-methylprop-2-enoate; 2-methylprop-2-enoic acid; prop-2-enoic acid; styrene
SYSTEMATIC NAME: butyl prop-2-enoate; ethenylbenzene; ethyl prop-2-enoate; methyl 2-methylprop-2-enoate; 2-methylprop-2-enoic acid; prop-2-enoic acid
MOLECULAR FORMULA: C32H46O10
MOLECULAR WEIGHT: 590.70164
SMILES: CCCCOC(=O)C=C.CCOC(=O)C=C.CC(=C)C(=O)O.CC(=C)C(=O)OC.C=CC1=CC=CC=C1.C=CC(=O)O
Structure:

CAS RN: 67815-95-6
CAS Name: 4-dodecylbenzenesulfonic acid; 2-(2-hydroxyethylamino)ethanol
OPENEYE Name: 4-dodecylbenzenesulfonic acid; 2-(2-hydroxyethylamino)ethanol
IUPAC Name: 4-dodecylbenzenesulfonic acid; 2-(2-hydroxyethylamino)ethanol
SYSTEMATIC NAME: 4-dodecylbenzenesulfonic acid; 2-(2-hydroxyethylamino)ethanol
MOLECULAR FORMULA: C22H41NO5S
MOLECULAR WEIGHT: 431.62964
SMILES: CCCCCCCCCCCCC1=CC=C(C=C1)S(=O)(=O)O.C(CO)NCCO
Structure:

CAS RN: 67815-87-6
CAS Name: 4,5-diisocyanatobicyclo[4.1.0]hepta-1(6),2,4-triene; ethane-1,2-diamine; 2-methyloxirane; propane-1,2-diol
OPENEYE Name: 4,5-diisocyanatobicyclo[4.1.0]hepta-1(6),2,4-triene; ethane-1,2-diamine; 2-methyloxirane; propane-1,2-diol
IUPAC Name: 4,5-diisocyanatobicyclo[4.1.0]hepta-1(6),2,4-triene; ethane-1,2-diamine; 2-methyloxirane; propane-1,2-diol
SYSTEMATIC NAME: 4,5-diisocyanatobicyclo[4.1.0]hepta-1(6),2,4-triene; ethane-1,2-diamine; 2-methyloxirane; propane-1,2-diol
MOLECULAR FORMULA: C17H26N4O5
MOLECULAR WEIGHT: 366.41214
SMILES: CC1CO1.CC(CO)O.C1C2=C1C(=C(C=C2)N=C=O)N=C=O.C(CN)N
Structure:

CAS RN: 67815-86-5
CAS Name: 1,3-diisocyanato-2-methylbenzene; 2-ethyl-2-(hydroxymethyl)propane-1,3-diol; hexane-1,6-diol
OPENEYE Name: 1,3-diisocyanato-2-methyl-benzene; 2-ethyl-2-(hydroxymethyl)propane-1,3-diol; hexane-1,6-diol
IUPAC Name: 1,3-diisocyanato-2-methylbenzene; 2-ethyl-2-(hydroxymethyl)propane-1,3-diol; hexane-1,6-diol
SYSTEMATIC NAME: 1,3-diisocyanato-2-methyl-benzene; 2-ethyl-2-(hydroxymethyl)propane-1,3-diol; hexane-1,6-diol
MOLECULAR FORMULA: C21H34N2O7
MOLECULAR WEIGHT: 426.50386
SMILES: CCC(CO)(CO)CO.CC1=C(C=CC=C1N=C=O)N=C=O.C(CCCO)CCO
Structure:

CAS RN: 67815-82-1
CAS Name: 2-ethylhexanoic acid; 2-ethyl-2-(hydroxymethyl)propane-1,3-diol; hexanedioic acid; isobenzofuran-1,3-dione
OPENEYE Name: adipic acid; 2-ethylhexanoic acid; 2-ethyl-2-(hydroxymethyl)propane-1,3-diol; isobenzofuran-1,3-dione
IUPAC Name: 2-benzofuran-1,3-dione; 2-ethylhexanoic acid; 2-ethyl-2-(hydroxymethyl)propane-1,3-diol; hexanedioic acid
SYSTEMATIC NAME: 2-benzofuran-1,3-dione; 2-ethylhexanoic acid; 2-ethyl-2-(hydroxymethyl)propane-1,3-diol; hexanedioic acid
MOLECULAR FORMULA: C28H44O12
MOLECULAR WEIGHT: 572.64176
SMILES: CCCCC(CC)C(=O)O.CCC(CO)(CO)CO.C1=CC=C2C(=C1)C(=O)OC2=O.C(CCC(=O)O)CC(=O)O
Structure:

CAS RN: 67815-75-2
CAS Name: 1,3-diisocyanato-2-methylbenzene; 2,4-diisocyanato-1-methylbenzene; ethane-1,2-diol; hexanedioic acid; 2-(2-hydroxyethoxy)ethanol
OPENEYE Name: adipic acid; 1,3-diisocyanato-2-methyl-benzene; 2,4-diisocyanato-1-methyl-benzene; ethylene glycol; 2-(2-hydroxyethoxy)ethanol
IUPAC Name: 1,3-diisocyanato-2-methylbenzene; 2,4-diisocyanato-1-methylbenzene; ethane-1,2-diol; hexanedioic acid; 2-(2-hydroxyethoxy)ethanol
SYSTEMATIC NAME: 1,3-diisocyanato-2-methyl-benzene; 2,4-diisocyanato-1-methyl-benzene; ethane-1,2-diol; hexanedioic acid; 2-(2-hydroxyethyloxy)ethanol
MOLECULAR FORMULA: C30H38N4O13
MOLECULAR WEIGHT: 662.64172
SMILES: CC1=C(C=C(C=C1)N=C=O)N=C=O.CC1=C(C=CC=C1N=C=O)N=C=O.C(CCC(=O)O)CC(=O)O.C(CO)O.C(COCCO)O
Structure:

CAS RN: 67815-72-9
CAS Name: benzene-1,3-dicarboxylic acid; 2,2-dimethylpropane-1,3-diol; hexanedioic acid; 2-(hydroxymethyl)-2-methylpropane-1,3-diol; isobenzofuran-1,3-dione
OPENEYE Name: adipic acid; 2,2-dimethylpropane-1,3-diol; 2-(hydroxymethyl)-2-methyl-propane-1,3-diol; isobenzofuran-1,3-dione; isophthalic acid
IUPAC Name: benzene-1,3-dicarboxylic acid; 2-benzofuran-1,3-dione; 2,2-dimethylpropane-1,3-diol; hexanedioic acid; 2-(hydroxymethyl)-2-methylpropane-1,3-diol
SYSTEMATIC NAME: benzene-1,3-dicarboxylic acid; 2-benzofuran-1,3-dione; 2,2-dimethylpropane-1,3-diol; hexanedioic acid; 2-(hydroxymethyl)-2-methyl-propane-1,3-diol
MOLECULAR FORMULA: C32H44O16
MOLECULAR WEIGHT: 684.68216
SMILES: CC(C)(CO)CO.CC(CO)(CO)CO.C1=CC=C2C(=C1)C(=O)OC2=O.C1=CC(=CC(=C1)C(=O)O)C(=O)O.C(CCC(=O)O)CC(=O)O
Structure:

CAS RN: 67814-76-0
CAS Name: (2S)-3-amino-N-[(1R,2S,3S,4R,5S)-5-amino-4-[[(2R,3R,4S,5S,6R)-6-(aminomethyl)-3,4,5-trihydroxy-2-oxanyl]oxy]-2-[[(2R,3R,4R,5R)-3,5-dihydroxy-5-methyl-4-(methylamino)-2-oxanyl]oxy]-3-hydroxycyclohexyl]-2-hydroxypropanamide sulfate
OPENEYE Name: (2S)-3-amino-N-[(1R,2S,3S,4R,5S)-5-amino-4-[(2R,3R,4S,5S,6R)-6-(aminomethyl)-3,4,5-trihydroxy-tetrahydropyran-2-yl]oxy-2-[(2R,3R,4R,5R)-3,5-dihydroxy-5-methyl-4-(methylamino)tetrahydropyran-2-yl]oxy-3-hydroxy-cyclohexyl]-2-hydroxy-propanamide sulfate
IUPAC Name: (2S)-3-amino-N-[(1R,2S,3S,4R,5S)-5-amino-4-[(2R,3R,4S,5S,6R)-6-(aminomethyl)-3,4,5-trihydroxyoxan-2-yl]oxy-2-[(2R,3R,4R,5R)-3,5-dihydroxy-5-methyl-4-(methylamino)oxan-2-yl]oxy-3-hydroxycyclohexyl]-2-hydroxypropanamide sulfate
SYSTEMATIC NAME: (2S)-N-[(1R,2S,3S,4R,5S)-4-[(2R,3R,4S,5S,6R)-6-(aminomethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-5-azanyl-2-[(2R,3R,4R,5R)-5-methyl-4-(methylamino)-3,5-bis(oxidanyl)oxan-2-yl]oxy-3-oxidanyl-cyclohexyl]-3-azanyl-2-oxidanyl-propanamide sulfate
MOLECULAR FORMULA: C22H43N5O16S-2
MOLECULAR WEIGHT: 665.66572
SMILES: C[C@@]1(CO[C@@H]([C@@H]([C@H]1NC)O)O[C@H]2[C@@H](C[C@@H]([C@H]([C@@H]2O)O[C@@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CN)O)O)O)N)NC(=O)[C@H](CN)O)O.[O-]S(=O)(=O)[O-]
Structure:

CAS RN: 67801-00-7
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C64H84CuN12O8S4
MOLECULAR WEIGHT: 1341.23336
SMILES: CCCCN(CCCC)S(=O)(=O)C1=CC2=C(C=C1)C3=NC4=NC(=NC5=NC(=NC6=C7C=CC(=CC7=C([N-]6)N=C2[N-]3)S(=O)(=O)N(CCCC)CCCC)C8=C5C=CC=C8S(=O)(=O)N(CCCC)CCCC)C9=C4C(=CC=C9)S(=O)(=O)N(CCCC)CCCC.[Cu+2]
Structure:

CAS RN: 67800-99-1
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C56H67CuN11O6S3
MOLECULAR WEIGHT: 1149.94228
SMILES: CCCCN(CCCC)S(=O)(=O)C1=CC2=C3[N-]C(=C2C=C1)N=C4C5=C(C=CC=C5S(=O)(=O)N(CCCC)CCCC)C(=N4)N=C6C7=C(C(=CC=C7)S(=O)(=O)N(CCCC)CCCC)C(=N6)N=C8C9=CC=CC=C9C(=N3)[N-]8.[Cu+2]
Structure:

CAS RN: 67800-94-6
CAS Name: 3-methylbenzene-1,2-diamine; 2-methyloxirane; oxirane
OPENEYE Name: 3-methylbenzene-1,2-diamine; 2-methyloxirane; oxirane
IUPAC Name: 3-methylbenzene-1,2-diamine; 2-methyloxirane; oxirane
SYSTEMATIC NAME: 3-methylbenzene-1,2-diamine; 2-methyloxirane; oxirane
MOLECULAR FORMULA: C12H20N2O2
MOLECULAR WEIGHT: 224.2994
SMILES: CC1CO1.CC1=C(C(=CC=C1)N)N.C1CO1
Structure:

CAS RN: 67786-31-6
CAS Name: N-(methoxymethyl)-2-methyl-2-propenamide; 2-propenamide; 2-propenoic acid butyl ester; styrene
OPENEYE Name: butyl prop-2-enoate; N-(methoxymethyl)-2-methyl-prop-2-enamide; prop-2-enamide; styrene
IUPAC Name: butyl prop-2-enoate; N-(methoxymethyl)-2-methylprop-2-enamide; prop-2-enamide; styrene
SYSTEMATIC NAME: butyl prop-2-enoate; ethenylbenzene; N-(methoxymethyl)-2-methyl-prop-2-enamide; prop-2-enamide
MOLECULAR FORMULA: C24H36N2O5
MOLECULAR WEIGHT: 432.55304
SMILES: CCCCOC(=O)C=C.CC(=C)C(=O)NCOC.C=CC1=CC=CC=C1.C=CC(=O)N
Structure:

CAS RN: 67786-08-7
CAS Name: 2-aminoethanol; 2-methylphenol
OPENEYE Name: 2-aminoethanol; o-cresol
IUPAC Name: 2-aminoethanol; 2-methylphenol
SYSTEMATIC NAME: 2-azanylethanol; 2-methylphenol
MOLECULAR FORMULA: C9H15NO2
MOLECULAR WEIGHT: 169.2209
SMILES: CC1=CC=CC=C1O.C(CO)N
Structure:

CAS RN: 67785-99-3
CAS Name: decaammonium N-[2-[bis(phosphonatomethyl)amino]ethyl]-N,N',N'-tris(phosphonatomethyl)ethane-1,2-diamine
OPENEYE Name: decaammonium N-[2-[bis(phosphonatomethyl)amino]ethyl]-N,N',N'-tris(phosphonatomethyl)ethane-1,2-diamine
IUPAC Name: decaazanium N-[2-[bis(phosphonatomethyl)amino]ethyl]-N,N',N'-tris(phosphonatomethyl)ethane-1,2-diamine
SYSTEMATIC NAME: decaazanium N-[2-[bis(phosphonatomethyl)amino]ethyl]-N,N',N'-tris(phosphonatomethyl)ethane-1,2-diamine
MOLECULAR FORMULA: C9H58N13O15P5
MOLECULAR WEIGHT: 743.503725
SMILES: C(CN(CP(=O)([O-])[O-])CP(=O)([O-])[O-])N(CCN(CP(=O)([O-])[O-])CP(=O)([O-])[O-])CP(=O)([O-])[O-].[NH4+].[NH4+].[NH4+].[NH4+].[NH4+].[NH4+].[NH4+].[NH4+].[NH4+].[NH4+]
Structure:

CAS RN: 67785-98-2
CAS Name: 2-hydroxyacetic acid; morpholine
OPENEYE Name: 2-hydroxyacetic acid; morpholine
IUPAC Name: 2-hydroxyacetic acid; morpholine
SYSTEMATIC NAME: morpholine; 2-oxidanylethanoic acid
MOLECULAR FORMULA: C6H13NO4
MOLECULAR WEIGHT: 163.17172
SMILES: C1COCCN1.C(C(=O)O)O
Structure:

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