Sunday, March 25, 2012

http://ChemLookup.com Compounds




CAS RN: 61328-46-9
CAS Name: 1,2-dichloro-4-(2,4-dichlorophenoxy)benzene
OPENEYE Name: 1,2-dichloro-4-(2,4-dichlorophenoxy)benzene
IUPAC Name: 1,2-dichloro-4-(2,4-dichlorophenoxy)benzene
SYSTEMATIC NAME: 1-[3,4-bis(chloranyl)phenoxy]-2,4-bis(chloranyl)benzene
MOLECULAR FORMULA: C12H6Cl4O
MOLECULAR WEIGHT: 307.98744
SMILES: C1=CC(=C(C=C1OC2=C(C=C(C=C2)Cl)Cl)Cl)Cl
Structure:

CAS RN: 61296-10-4
CAS Name: N-(6-chloro-3-pyridazinyl)nitramide
OPENEYE Name: N-(6-chloropyridazin-3-yl)nitramide
IUPAC Name: N-(6-chloropyridazin-3-yl)nitramide
SYSTEMATIC NAME: N-(6-chloranylpyridazin-3-yl)nitramide
MOLECULAR FORMULA: C4H3ClN4O2
MOLECULAR WEIGHT: 174.54522
SMILES: C1=CC(=NN=C1N[N+](=O)[O-])Cl
Structure:

CAS RN: 61260-54-6
CAS Name: N,N'-bis(2,2,6,6-tetramethyl-4-piperidinyl)ethane-1,2-diamine
OPENEYE Name: N,N'-bis(2,2,6,6-tetramethyl-4-piperidyl)ethane-1,2-diamine
IUPAC Name: N,N'-bis(2,2,6,6-tetramethylpiperidin-4-yl)ethane-1,2-diamine
SYSTEMATIC NAME: N,N'-bis(2,2,6,6-tetramethylpiperidin-4-yl)ethane-1,2-diamine
MOLECULAR FORMULA: C20H42N4
MOLECULAR WEIGHT: 338.57428
SMILES: CC1(CC(CC(N1)(C)C)NCCNC2CC(NC(C2)(C)C)(C)C)C
Structure:

CAS RN: 61220-37-9
CAS Name: N'-[1-(phenylmethyl)-4-piperidinyl]propane-1,3-diamine
OPENEYE Name: N'-(1-benzyl-4-piperidyl)propane-1,3-diamine
IUPAC Name: N'-(1-benzylpiperidin-4-yl)propane-1,3-diamine
SYSTEMATIC NAME: N'-[1-(phenylmethyl)piperidin-4-yl]propane-1,3-diamine
MOLECULAR FORMULA: C15H25N3
MOLECULAR WEIGHT: 247.3791
SMILES: C1CN(CCC1NCCCN)CC2=CC=CC=C2
Structure:

CAS RN: 61219-93-0
CAS Name: N-prop-2-enyl-3-(trifluoromethyl)aniline
OPENEYE Name: N-allyl-3-(trifluoromethyl)aniline
IUPAC Name: N-prop-2-enyl-3-(trifluoromethyl)aniline
SYSTEMATIC NAME: N-prop-2-enyl-3-(trifluoromethyl)aniline
MOLECULAR FORMULA: C10H10F3N
MOLECULAR WEIGHT: 201.18831
SMILES: C=CCNC1=CC=CC(=C1)C(F)(F)F
Structure:

CAS RN: 61214-14-0
CAS Name: 3-chloropropyl-tri(propan-2-yloxy)silane
OPENEYE Name: 3-chloropropyl(triisopropoxy)silane
IUPAC Name: 3-chloropropyl-tri(propan-2-yloxy)silane
SYSTEMATIC NAME: 3-chloranylpropyl-tri(propan-2-yloxy)silane
MOLECULAR FORMULA: C12H27ClO3Si
MOLECULAR WEIGHT: 282.87948
SMILES: CC(C)O[Si](CCCCl)(OC(C)C)OC(C)C
Structure:

CAS RN: 61214-13-9
CAS Name: methyl-tris(phenylmethoxy)silane
OPENEYE Name: tribenzyloxy(methyl)silane
IUPAC Name: methyl-tris(phenylmethoxy)silane
SYSTEMATIC NAME: methyl-tris(phenylmethoxy)silane
MOLECULAR FORMULA: C22H24O3Si
MOLECULAR WEIGHT: 364.50966
SMILES: C[Si](OCC1=CC=CC=C1)(OCC2=CC=CC=C2)OCC3=CC=CC=C3
Structure:

CAS RN: 61214-12-8
CAS Name: 3-chloropropyl(tripropoxy)silane
OPENEYE Name: 3-chloropropyl(tripropoxy)silane
IUPAC Name: 3-chloropropyl(tripropoxy)silane
SYSTEMATIC NAME: 3-chloranylpropyl(tripropoxy)silane
MOLECULAR FORMULA: C12H27ClO3Si
MOLECULAR WEIGHT: 282.87948
SMILES: CCCO[Si](CCCCl)(OCCC)OCCC
Structure:

CAS RN: 61209-66-3
CAS Name: 8-chloro-1-naphthalenethiol
OPENEYE Name: 8-chloronaphthalene-1-thiol
IUPAC Name: 8-chloronaphthalene-1-thiol
SYSTEMATIC NAME: 8-chloranylnaphthalene-1-thiol
MOLECULAR FORMULA: C10H7ClS
MOLECULAR WEIGHT: 194.68058
SMILES: C1=CC2=C(C(=C1)S)C(=CC=C2)Cl
Structure:

CAS RN: 61204-02-2
CAS Name: 4-(4-hexylcyclohexyl)benzonitrile
OPENEYE Name: 4-(4-hexylcyclohexyl)benzonitrile
IUPAC Name: 4-(4-hexylcyclohexyl)benzonitrile
SYSTEMATIC NAME: 4-(4-hexylcyclohexyl)benzenecarbonitrile
MOLECULAR FORMULA: C19H27N
MOLECULAR WEIGHT: 269.42438
SMILES: CCCCCCC1CCC(CC1)C2=CC=C(C=C2)C#N
Structure:

CAS RN: 61202-97-9
CAS Name: 3-methyl-2,4-dioxohexanoic acid ethyl ester
OPENEYE Name: ethyl 3-methyl-2,4-dioxo-hexanoate
IUPAC Name: ethyl 3-methyl-2,4-dioxohexanoate
SYSTEMATIC NAME: ethyl 3-methyl-2,4-bis(oxidanylidene)hexanoate
MOLECULAR FORMULA: C9H14O4
MOLECULAR WEIGHT: 186.20506
SMILES: CCC(=O)C(C)C(=O)C(=O)OCC
Structure:

CAS RN: 61175-77-7
CAS Name: butyl(tripropyl)ammonium bromide
OPENEYE Name: butyl(tripropyl)ammonium bromide
IUPAC Name: butyl(tripropyl)azanium bromide
SYSTEMATIC NAME: butyl(tripropyl)azanium bromide
MOLECULAR FORMULA: C13H30BrN
MOLECULAR WEIGHT: 280.288
SMILES: CCCC[N+](CCC)(CCC)CCC.[Br-]
Structure:

CAS RN: 61168-62-5
CAS Name: ammonium 2-ethylbenzenesulfonate
OPENEYE Name: ammonium 2-ethylbenzenesulfonate
IUPAC Name: azanium 2-ethylbenzenesulfonate
SYSTEMATIC NAME: azanium 2-ethylbenzenesulfonate
MOLECULAR FORMULA: C8H13NO3S
MOLECULAR WEIGHT: 203.25872
SMILES: CCC1=CC=CC=C1S(=O)(=O)[O-].[NH4+]
Structure:

CAS RN: 61147-38-4
CAS Name: 2-[4-(2-methylpropyl)phenyl]butanoic acid 2-[2-(diethylamino)ethoxy]ethyl ester
OPENEYE Name: 2-[2-(diethylamino)ethoxy]ethyl 2-(4-isobutylphenyl)butanoate
IUPAC Name: 2-[2-(diethylamino)ethoxy]ethyl 2-[4-(2-methylpropyl)phenyl]butanoate
SYSTEMATIC NAME: 2-[2-(diethylamino)ethoxy]ethyl 2-[4-(2-methylpropyl)phenyl]butanoate
MOLECULAR FORMULA: C22H37NO3
MOLECULAR WEIGHT: 363.53408
SMILES: CCC(C1=CC=C(C=C1)CC(C)C)C(=O)OCCOCCN(CC)CC
Structure:

CAS RN: 61138-44-1
CAS Name: 4-chloro-3-[[1-(2,6-dichloro-4-methylsulfonylphenyl)-5-oxo-4H-pyrazol-3-yl]amino]-N-hexadecyl-N-methylbenzamide
OPENEYE Name: 4-chloro-3-[[1-(2,6-dichloro-4-methylsulfonyl-phenyl)-5-oxo-4H-pyrazol-3-yl]amino]-N-hexadecyl-N-methyl-benzamide
IUPAC Name: 4-chloro-3-[[1-(2,6-dichloro-4-methylsulfonylphenyl)-5-oxo-4H-pyrazol-3-yl]amino]-N-hexadecyl-N-methylbenzamide
SYSTEMATIC NAME: 3-[[1-[2,6-bis(chloranyl)-4-methylsulfonyl-phenyl]-5-oxidanylidene-4H-pyrazol-3-yl]amino]-4-chloranyl-N-hexadecyl-N-methyl-benzamide
MOLECULAR FORMULA: C34H47Cl3N4O4S
MOLECULAR WEIGHT: 714.18538
SMILES: CCCCCCCCCCCCCCCCN(C)C(=O)C1=CC(=C(C=C1)Cl)NC2=NN(C(=O)C2)C3=C(C=C(C=C3Cl)S(=O)(=O)C)Cl
Structure:

CAS RN: 61114-41-8
CAS Name: 2-(4-chlorophenyl)-1-cyclopropanamine
OPENEYE Name: 2-(4-chlorophenyl)cyclopropanamine
IUPAC Name: 2-(4-chlorophenyl)cyclopropan-1-amine
SYSTEMATIC NAME: 2-(4-chlorophenyl)cyclopropan-1-amine
MOLECULAR FORMULA: C9H10ClN
MOLECULAR WEIGHT: 167.6354
SMILES: C1C(C1N)C2=CC=C(C=C2)Cl
Structure:

CAS RN: 61086-12-2
CAS Name: N-[4-(methoxymethyl)-1-(phenylmethyl)-4-piperidinyl]-N-phenylpropanamide
OPENEYE Name: N-[1-benzyl-4-(methoxymethyl)-4-piperidyl]-N-phenyl-propanamide
IUPAC Name: N-[1-benzyl-4-(methoxymethyl)piperidin-4-yl]-N-phenylpropanamide
SYSTEMATIC NAME: N-[4-(methoxymethyl)-1-(phenylmethyl)piperidin-4-yl]-N-phenyl-propanamide
MOLECULAR FORMULA: C23H30N2O2
MOLECULAR WEIGHT: 366.4965
SMILES: CCC(=O)N(C1=CC=CC=C1)C2(CCN(CC2)CC3=CC=CC=C3)COC
Structure:

CAS RN: 61086-04-2
CAS Name: [4-anilino-1-(phenylmethyl)-4-piperidinyl]methanol
OPENEYE Name: (4-anilino-1-benzyl-4-piperidyl)methanol
IUPAC Name: (4-anilino-1-benzylpiperidin-4-yl)methanol
SYSTEMATIC NAME: [4-phenylazanyl-1-(phenylmethyl)piperidin-4-yl]methanol
MOLECULAR FORMULA: C19H24N2O
MOLECULAR WEIGHT: 296.40666
SMILES: C1CN(CCC1(CO)NC2=CC=CC=C2)CC3=CC=CC=C3
Structure:

CAS RN: 61085-41-4
CAS Name: 4-(4-fluoroanilino)-1-(phenylmethyl)-4-piperidinecarboxamide
OPENEYE Name: 1-benzyl-4-(4-fluoroanilino)piperidine-4-carboxamide
IUPAC Name: 1-benzyl-4-(4-fluoroanilino)piperidine-4-carboxamide
SYSTEMATIC NAME: 4-[(4-fluorophenyl)amino]-1-(phenylmethyl)piperidine-4-carboxamide
MOLECULAR FORMULA: C19H22FN3O
MOLECULAR WEIGHT: 327.395883
SMILES: C1CN(CCC1(C(=O)N)NC2=CC=C(C=C2)F)CC3=CC=CC=C3
Structure:

CAS RN: 61085-37-8
CAS Name: 4-(4-fluoroanilino)-1-(phenylmethyl)-4-piperidinecarbonitrile
OPENEYE Name: 1-benzyl-4-(4-fluoroanilino)piperidine-4-carbonitrile
IUPAC Name: 1-benzyl-4-(4-fluoroanilino)piperidine-4-carbonitrile
SYSTEMATIC NAME: 4-[(4-fluorophenyl)amino]-1-(phenylmethyl)piperidine-4-carbonitrile
MOLECULAR FORMULA: C19H20FN3
MOLECULAR WEIGHT: 309.380603
SMILES: C1CN(CCC1(C#N)NC2=CC=C(C=C2)F)CC3=CC=CC=C3
Structure:

CAS RN: 61083-59-8
CAS Name: 2-carbonochloridoyloxyethyl(triphenyl)phosphonium chloride
OPENEYE Name: 2-chlorocarbonyloxyethyl(triphenyl)phosphonium chloride
IUPAC Name: 2-carbonochloridoyloxyethyl(triphenyl)phosphanium chloride
SYSTEMATIC NAME: 2-carbonochloridoyloxyethyl(triphenyl)phosphanium chloride
MOLECULAR FORMULA: C21H19Cl2O2P
MOLECULAR WEIGHT: 405.254121
SMILES: C1=CC=C(C=C1)[P+](CCOC(=O)Cl)(C2=CC=CC=C2)C3=CC=CC=C3.[Cl-]
Structure:

CAS RN: 60984-93-2
CAS Name: 4-(2,2-dichloro-1,1-difluoroethoxy)aniline
OPENEYE Name: 4-(2,2-dichloro-1,1-difluoro-ethoxy)aniline
IUPAC Name: 4-(2,2-dichloro-1,1-difluoroethoxy)aniline
SYSTEMATIC NAME: 4-[2,2-bis(chloranyl)-1,1-bis(fluoranyl)ethoxy]aniline
MOLECULAR FORMULA: C8H7Cl2F2NO
MOLECULAR WEIGHT: 242.050086
SMILES: C1=CC(=CC=C1N)OC(C(Cl)Cl)(F)F
Structure:

CAS RN: 60951-03-3
CAS Name: 1-hexoxynaphthalene
OPENEYE Name: 1-hexoxynaphthalene
IUPAC Name: 1-hexoxynaphthalene
SYSTEMATIC NAME: 1-hexoxynaphthalene
MOLECULAR FORMULA: C16H20O
MOLECULAR WEIGHT: 228.3294
SMILES: CCCCCCOC1=CC=CC2=CC=CC=C21
Structure:

CAS RN: 60848-34-2
CAS Name: 1-butan-2-yl-4-methylnaphthalene
OPENEYE Name: 1-methyl-4-sec-butyl-naphthalene
IUPAC Name: 1-butan-2-yl-4-methylnaphthalene
SYSTEMATIC NAME: 1-butan-2-yl-4-methyl-naphthalene
MOLECULAR FORMULA: C15H18
MOLECULAR WEIGHT: 198.30342
SMILES: CCC(C)C1=CC=C(C2=CC=CC=C21)C
Structure:

1 comment:

  1. As a global Contract Research Organization (CRO), headquartered in New York, USA, Alfa Chemistry has served the pharmaceutical and biotechnology industries for eight years. 1-chloro-1-(4-isobutylphenyl)ethane density

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