Friday, November 30, 2012

http://ChemLookup.com Compounds




CAS RN: 19026-91-6
CAS Name: 11,11-difluorobicyclo[4.4.1]undeca-1,3,5,7,9-pentaene
OPENEYE Name: 11,11-difluorobicyclo[4.4.1]undeca-1,3,5,7,9-pentaene
IUPAC Name: 11,11-difluorobicyclo[4.4.1]undeca-1,3,5,7,9-pentaene
SYSTEMATIC NAME: 11,11-bis(fluoranyl)bicyclo[4.4.1]undeca-1,3,5,7,9-pentaene
MOLECULAR FORMULA: C11H8F2
MOLECULAR WEIGHT: 178.178026
SMILES: C1=CC=C2C=CC=CC(=C1)C2(F)F
Structure:

CAS RN: 19019-10-4
CAS Name: 9,9-dimethylthioxanthene
OPENEYE Name: 9,9-dimethylthioxanthene
IUPAC Name: 9,9-dimethylthioxanthene
SYSTEMATIC NAME: 9,9-dimethylthioxanthene
MOLECULAR FORMULA: C15H14S
MOLECULAR WEIGHT: 226.33666
SMILES: CC1(C2=CC=CC=C2SC3=CC=CC=C31)C
Structure:

CAS RN: 19010-96-9
CAS Name: 1-isothiocyanatoundecane
OPENEYE Name: 1-isothiocyanatoundecane
IUPAC Name: 1-isothiocyanatoundecane
SYSTEMATIC NAME: 1-isothiocyanatoundecane
MOLECULAR FORMULA: C12H23NS
MOLECULAR WEIGHT: 213.38272
SMILES: CCCCCCCCCCCN=C=S
Structure:

CAS RN: 19006-63-4
CAS Name: 1-propyl-2-pyridinone
OPENEYE Name: 1-propylpyridin-2-one
IUPAC Name: 1-propylpyridin-2-one
SYSTEMATIC NAME: 1-propylpyridin-2-one
MOLECULAR FORMULA: C8H11NO
MOLECULAR WEIGHT: 137.17904
SMILES: CCCN1C=CC=CC1=O
Structure:

CAS RN: 19005-04-0
CAS Name: bicyclo[2.2.2]octa-2,5-diene-2,3-dicarbonitrile
OPENEYE Name: bicyclo[2.2.2]octa-2,5-diene-2,3-dicarbonitrile
IUPAC Name: bicyclo[2.2.2]octa-2,5-diene-2,3-dicarbonitrile
SYSTEMATIC NAME: bicyclo[2.2.2]octa-2,5-diene-2,3-dicarbonitrile
MOLECULAR FORMULA: C10H8N2
MOLECULAR WEIGHT: 156.18392
SMILES: C1CC2C=CC1C(=C2C#N)C#N
Structure:

CAS RN: 18995-35-2
CAS Name: 1-chloro-4-[(2-methylpropan-2-yl)oxy]benzene
OPENEYE Name: 1-tert-butoxy-4-chloro-benzene
IUPAC Name: 1-chloro-4-[(2-methylpropan-2-yl)oxy]benzene
SYSTEMATIC NAME: 1-chloranyl-4-[(2-methylpropan-2-yl)oxy]benzene
MOLECULAR FORMULA: C10H13ClO
MOLECULAR WEIGHT: 184.66262
SMILES: CC(C)(C)OC1=CC=C(C=C1)Cl
Structure:

CAS RN: 18978-78-4
CAS Name: 2-methyl-8-quinolinamine
OPENEYE Name: 2-methylquinolin-8-amine
IUPAC Name: 2-methylquinolin-8-amine
SYSTEMATIC NAME: 2-methylquinolin-8-amine
MOLECULAR FORMULA: C10H10N2
MOLECULAR WEIGHT: 158.1998
SMILES: CC1=NC2=C(C=CC=C2N)C=C1
Structure:

CAS RN: 18969-93-2
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C14H12N2
MOLECULAR WEIGHT: 208.25848
SMILES: CN1C=NC2=C3C1=CC=C4C3=C(CC4)C=C2
Structure:

CAS RN: 18967-41-4
CAS Name: 2,4-dichloro-1-(isothiocyanatomethyl)benzene
OPENEYE Name: 2,4-dichloro-1-(isothiocyanatomethyl)benzene
IUPAC Name: 2,4-dichloro-1-(isothiocyanatomethyl)benzene
SYSTEMATIC NAME: 2,4-bis(chloranyl)-1-(isothiocyanatomethyl)benzene
MOLECULAR FORMULA: C8H5Cl2NS
MOLECULAR WEIGHT: 218.103
SMILES: C1=CC(=C(C=C1Cl)Cl)CN=C=S
Structure:

CAS RN: 18967-35-6
CAS Name: 3-isothiocyanatopropanoic acid methyl ester
OPENEYE Name: methyl 3-isothiocyanatopropanoate
IUPAC Name: methyl 3-isothiocyanatopropanoate
SYSTEMATIC NAME: methyl 3-isothiocyanatopropanoate
MOLECULAR FORMULA: C5H7NO2S
MOLECULAR WEIGHT: 145.17958
SMILES: COC(=O)CCN=C=S
Structure:

CAS RN: 18938-24-4
CAS Name: 1,2-bis(trimethylsilyl)ethenyl-trimethylsilane
OPENEYE Name: 1,2-bis(trimethylsilyl)vinyl-trimethyl-silane
IUPAC Name: 1,2-bis(trimethylsilyl)ethenyl-trimethylsilane
SYSTEMATIC NAME: 1,2-bis(trimethylsilyl)ethenyl-trimethyl-silane
MOLECULAR FORMULA: C11H28Si3
MOLECULAR WEIGHT: 244.59652
SMILES: C[Si](C)(C)C=C([Si](C)(C)C)[Si](C)(C)C
Structure:

CAS RN: 18931-82-3
CAS Name: N-(2-chloro-5-methylphenyl)formamide
OPENEYE Name: N-(2-chloro-5-methyl-phenyl)formamide
IUPAC Name: N-(2-chloro-5-methylphenyl)formamide
SYSTEMATIC NAME: N-(2-chloranyl-5-methyl-phenyl)methanamide
MOLECULAR FORMULA: C8H8ClNO
MOLECULAR WEIGHT: 169.60822
SMILES: CC1=CC(=C(C=C1)Cl)NC=O
Structure:

CAS RN: 18931-77-6
CAS Name: N-(2-chloro-4-methylphenyl)formamide
OPENEYE Name: N-(2-chloro-4-methyl-phenyl)formamide
IUPAC Name: N-(2-chloro-4-methylphenyl)formamide
SYSTEMATIC NAME: N-(2-chloranyl-4-methyl-phenyl)methanamide
MOLECULAR FORMULA: C8H8ClNO
MOLECULAR WEIGHT: 169.60822
SMILES: CC1=CC(=C(C=C1)NC=O)Cl
Structure:

CAS RN: 18922-69-5
CAS Name: 2-methyltriazole
OPENEYE Name: 2-methyltriazole
IUPAC Name: 2-methyltriazole
SYSTEMATIC NAME: 2-methyl-1,2,3-triazole
MOLECULAR FORMULA: C3H5N3
MOLECULAR WEIGHT: 83.0919
SMILES: CN1N=CC=N1
Structure:

CAS RN: 18913-35-4
CAS Name: buta-2,3-dienoic acid methyl ester
OPENEYE Name: methyl buta-2,3-dienoate
IUPAC Name: methyl buta-2,3-dienoate
SYSTEMATIC NAME: methyl buta-2,3-dienoate
MOLECULAR FORMULA: C5H6O2
MOLECULAR WEIGHT: 98.09994
SMILES: COC(=O)C=C=C
Structure:

CAS RN: 18913-31-0
CAS Name: 1-buta-2,3-dienol
OPENEYE Name: buta-2,3-dien-1-ol
IUPAC Name: buta-2,3-dien-1-ol
SYSTEMATIC NAME: buta-2,3-dien-1-ol
MOLECULAR FORMULA: C4H6O
MOLECULAR WEIGHT: 70.08984
SMILES: C=C=CCO
Structure:

CAS RN: 18903-54-3
CAS Name: 1,2,3,4,6,7,8,9-octahydroazaborino[1,2-a]azaborine
OPENEYE Name: 1,2,3,4,6,7,8,9-octahydroazaborinino[1,2-a]azaborinine
IUPAC Name: 1,2,3,4,6,7,8,9-octahydroazaborinino[1,2-a]azaborinine
SYSTEMATIC NAME: 1,2,3,4,6,7,8,9-octahydro-[1,2]azaborinino[1,2-a][1,2]azaborinine
MOLECULAR FORMULA: C8H16BN
MOLECULAR WEIGHT: 137.03034
SMILES: B12CCCCN1CCCC2
Structure:

CAS RN: 18895-06-2
CAS Name: 6-cyclohepta[c]furanone
OPENEYE Name: cyclohepta[c]furan-6-one
IUPAC Name: cyclohepta[c]furan-6-one
SYSTEMATIC NAME: cyclohepta[c]furan-6-one
MOLECULAR FORMULA: C9H6O2
MOLECULAR WEIGHT: 146.14274
SMILES: C1=CC2=COC=C2C=CC1=O
Structure:

CAS RN: 18888-98-7
CAS Name: 4-(3-amino-4-anilinophenoxy)-N1-phenylbenzene-1,2-diamine
OPENEYE Name: 4-(3-amino-4-anilino-phenoxy)-N1-phenyl-benzene-1,2-diamine
IUPAC Name: 4-(3-amino-4-anilinophenoxy)-1-N-phenylbenzene-1,2-diamine
SYSTEMATIC NAME: 4-(3-azanyl-4-phenylazanyl-phenoxy)-N1-phenyl-benzene-1,2-diamine
MOLECULAR FORMULA: C24H22N4O
MOLECULAR WEIGHT: 382.45768
SMILES: C1=CC=C(C=C1)NC2=C(C=C(C=C2)OC3=CC(=C(C=C3)NC4=CC=CC=C4)N)N
Structure:

CAS RN: 18888-46-5
CAS Name: 2-(ethenylthio)propane
OPENEYE Name: 2-vinylsulfanylpropane
IUPAC Name: 2-ethenylsulfanylpropane
SYSTEMATIC NAME: 2-ethenylsulfanylpropane
MOLECULAR FORMULA: C5H10S
MOLECULAR WEIGHT: 102.1979
SMILES: CC(C)SC=C
Structure:

CAS RN: 18864-76-1
CAS Name: phenyl-(4-propan-2-ylphenyl)methanone
OPENEYE Name: (4-isopropylphenyl)-phenyl-methanone
IUPAC Name: phenyl-(4-propan-2-ylphenyl)methanone
SYSTEMATIC NAME: phenyl-(4-propan-2-ylphenyl)methanone
MOLECULAR FORMULA: C16H16O
MOLECULAR WEIGHT: 224.29764
SMILES: CC(C)C1=CC=C(C=C1)C(=O)C2=CC=CC=C2
Structure:

CAS RN: 18856-68-3
CAS Name: 2-(dimethylaminomethylidene)propanedioic acid diethyl ester
OPENEYE Name: diethyl 2-(dimethylaminomethylene)propanedioate
IUPAC Name: diethyl 2-(dimethylaminomethylidene)propanedioate
SYSTEMATIC NAME: diethyl 2-(dimethylaminomethylidene)propanedioate
MOLECULAR FORMULA: C10H17NO4
MOLECULAR WEIGHT: 215.24628
SMILES: CCOC(=O)C(=CN(C)C)C(=O)OCC
Structure:

CAS RN: 18856-63-8
CAS Name: 1-ethyl-4-isothiocyanatobenzene
OPENEYE Name: 1-ethyl-4-isothiocyanato-benzene
IUPAC Name: 1-ethyl-4-isothiocyanatobenzene
SYSTEMATIC NAME: 1-ethyl-4-isothiocyanato-benzene
MOLECULAR FORMULA: C9H9NS
MOLECULAR WEIGHT: 163.23946
SMILES: CCC1=CC=C(C=C1)N=C=S
Structure:

CAS RN: 18854-56-3
CAS Name: 1-(2-propoxyethoxy)propane
OPENEYE Name: 1-(2-propoxyethoxy)propane
IUPAC Name: 1-(2-propoxyethoxy)propane
SYSTEMATIC NAME: 1-(2-propoxyethoxy)propane
MOLECULAR FORMULA: C8H18O2
MOLECULAR WEIGHT: 146.22732
SMILES: CCCOCCOCCC
Structure:

CAS RN: 18853-40-2
CAS Name: thiophene-2,5-dicarbonitrile
OPENEYE Name: thiophene-2,5-dicarbonitrile
IUPAC Name: thiophene-2,5-dicarbonitrile
SYSTEMATIC NAME: thiophene-2,5-dicarbonitrile
MOLECULAR FORMULA: C6H2N2S
MOLECULAR WEIGHT: 134.15848
SMILES: C1=C(SC(=C1)C#N)C#N
Structure:

CAS RN: 18853-32-2
CAS Name: thiophene-3,4-dicarbonitrile
OPENEYE Name: thiophene-3,4-dicarbonitrile
IUPAC Name: thiophene-3,4-dicarbonitrile
SYSTEMATIC NAME: thiophene-3,4-dicarbonitrile
MOLECULAR FORMULA: C6H2N2S
MOLECULAR WEIGHT: 134.15848
SMILES: C1=C(C(=CS1)C#N)C#N
Structure:

CAS RN: 18848-96-9
CAS Name: tris(4-trimethylsilylphenyl)phosphine
OPENEYE Name: tris(4-trimethylsilylphenyl)phosphane
IUPAC Name: tris(4-trimethylsilylphenyl)phosphane
SYSTEMATIC NAME: tris(4-trimethylsilylphenyl)phosphane
MOLECULAR FORMULA: C27H39PSi3
MOLECULAR WEIGHT: 478.828821
SMILES: C[Si](C)(C)C1=CC=C(C=C1)P(C2=CC=C(C=C2)[Si](C)(C)C)C3=CC=C(C=C3)[Si](C)(C)C
Structure:

CAS RN: 18835-47-7
CAS Name: N-(2,6-dimethylphenyl)-N-methylacetamide
OPENEYE Name: N-(2,6-dimethylphenyl)-N-methyl-acetamide
IUPAC Name: N-(2,6-dimethylphenyl)-N-methylacetamide
SYSTEMATIC NAME: N-(2,6-dimethylphenyl)-N-methyl-ethanamide
MOLECULAR FORMULA: C11H15NO
MOLECULAR WEIGHT: 177.2429
SMILES: CC1=C(C(=CC=C1)C)N(C)C(=O)C
Structure:

CAS RN: 18826-62-5
CAS Name: 1-methyl-3-prop-1-ynylbenzene
OPENEYE Name: 1-methyl-3-prop-1-ynyl-benzene
IUPAC Name: 1-methyl-3-prop-1-ynylbenzene
SYSTEMATIC NAME: 1-methyl-3-prop-1-ynyl-benzene
MOLECULAR FORMULA: C10H10
MOLECULAR WEIGHT: 130.1864
SMILES: CC#CC1=CC(=CC=C1)C
Structure:

CAS RN: 18820-63-8
CAS Name: fluoro(nitrilo)-$l^{4}-sulfane
OPENEYE Name: fluoro(nitrido)-$l^{4}-sulfane
IUPAC Name: azanylidyne(fluoro)-$l^{4}-sulfane
SYSTEMATIC NAME: azanylidyne(fluoranyl)-$l^{4}-sulfane
MOLECULAR FORMULA: FNS
MOLECULAR WEIGHT: 65.070103
SMILES: N#SF
Structure:

CAS RN: 18820-56-9
CAS Name: difluoroplatinum
OPENEYE Name: difluoroplatinum
IUPAC Name: difluoroplatinum
SYSTEMATIC NAME: bis(fluoranyl)platinum
MOLECULAR FORMULA: F2Pt
MOLECULAR WEIGHT: 233.074806
SMILES: F[Pt]F
Structure:

CAS RN: 18812-51-6
CAS Name: 1-diethoxyphosphorylpropane
OPENEYE Name: 1-diethoxyphosphorylpropane
IUPAC Name: 1-diethoxyphosphorylpropane
SYSTEMATIC NAME: 1-diethoxyphosphorylpropane
MOLECULAR FORMULA: C7H17O3P
MOLECULAR WEIGHT: 180.181841
SMILES: CCCP(=O)(OCC)OCC
Structure:

CAS RN: 18805-25-9
CAS Name: N-methyl-1,1-bis(methylthio)methanimine
OPENEYE Name: N-methyl-1,1-bis(methylsulfanyl)methanimine
IUPAC Name: N-methyl-1,1-bis(methylsulfanyl)methanimine
SYSTEMATIC NAME: N-methyl-1,1-bis(methylsulfanyl)methanimine
MOLECULAR FORMULA: C4H9NS2
MOLECULAR WEIGHT: 135.25096
SMILES: CN=C(SC)SC
Structure:

CAS RN: 18799-75-2
CAS Name: bis(trifluoromethylthio)phosphine
OPENEYE Name: bis(trifluoromethylsulfanyl)phosphane
IUPAC Name: bis(trifluoromethylsulfanyl)phosphane
SYSTEMATIC NAME: bis(trifluoromethylsulfanyl)phosphane
MOLECULAR FORMULA: C2HF6PS2
MOLECULAR WEIGHT: 234.12352
SMILES: C(F)(F)(F)SPSC(F)(F)F
Structure:

CAS RN: 18794-33-7
CAS Name: 3-(methylthio)pyridine
OPENEYE Name: 3-methylsulfanylpyridine
IUPAC Name: 3-methylsulfanylpyridine
SYSTEMATIC NAME: 3-methylsulfanylpyridine
MOLECULAR FORMULA: C6H7NS
MOLECULAR WEIGHT: 125.19148
SMILES: CSC1=CN=CC=C1
Structure:

CAS RN: 18781-42-5
CAS Name: 2-methyl-1-benzothiophene-6-carboxylic acid methyl ester
OPENEYE Name: methyl 2-methylbenzothiophene-6-carboxylate
IUPAC Name: methyl 2-methyl-1-benzothiophene-6-carboxylate
SYSTEMATIC NAME: methyl 2-methyl-1-benzothiophene-6-carboxylate
MOLECULAR FORMULA: C11H10O2S
MOLECULAR WEIGHT: 206.2609
SMILES: CC1=CC2=C(S1)C=C(C=C2)C(=O)OC
Structure:

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