Sunday, December 2, 2012

http://ChemLookup.com Compounds




CAS RN: 13041-10-6
CAS Name: 7-methoxybicyclo[2.2.1]hept-2-ene
OPENEYE Name: 7-methoxybicyclo[2.2.1]hept-2-ene
IUPAC Name: 7-methoxybicyclo[2.2.1]hept-2-ene
SYSTEMATIC NAME: 7-methoxybicyclo[2.2.1]hept-2-ene
MOLECULAR FORMULA: C8H12O
MOLECULAR WEIGHT: 124.18028
SMILES: COC1C2CCC1C=C2
Structure:

CAS RN: 36197-25-8
CAS Name: 7-methoxybicyclo[2.2.1]hept-2-ene
OPENEYE Name: 7-methoxybicyclo[2.2.1]hept-2-ene
IUPAC Name: 7-methoxybicyclo[2.2.1]hept-2-ene
SYSTEMATIC NAME: 7-methoxybicyclo[2.2.1]hept-2-ene
MOLECULAR FORMULA: C8H12O
MOLECULAR WEIGHT: 124.18028
SMILES: COC1C2CCC1C=C2
Structure:

CAS RN: 13031-49-7
CAS Name: N-(3-methoxyphenyl)benzamide
OPENEYE Name: N-(3-methoxyphenyl)benzamide
IUPAC Name: N-(3-methoxyphenyl)benzamide
SYSTEMATIC NAME: N-(3-methoxyphenyl)benzamide
MOLECULAR FORMULA: C14H13NO2
MOLECULAR WEIGHT: 227.25852
SMILES: COC1=CC=CC(=C1)NC(=O)C2=CC=CC=C2
Structure:

CAS RN: 13030-50-7
CAS Name: 4-(methylthio)but-1-en-3-yne
OPENEYE Name: 4-methylsulfanylbut-1-en-3-yne
IUPAC Name: 4-methylsulfanylbut-1-en-3-yne
SYSTEMATIC NAME: 4-methylsulfanylbut-1-en-3-yne
MOLECULAR FORMULA: C5H6S
MOLECULAR WEIGHT: 98.16614
SMILES: CSC#CC=C
Structure:

CAS RN: 13027-75-3
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C8H12
MOLECULAR WEIGHT: 108.18088
SMILES: C1CC2C1C3C2CC3
Structure:

CAS RN: 28636-10-4
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C8H12
MOLECULAR WEIGHT: 108.18088
SMILES: C1CC2C1C3C2CC3
Structure:

CAS RN: 13025-73-5
CAS Name: 3,3,3-trideuterio-1-propyne
OPENEYE Name: 3,3,3-trideuterioprop-1-yne
IUPAC Name: 3,3,3-trideuterioprop-1-yne
SYSTEMATIC NAME: 3,3,3-trideuterioprop-1-yne
MOLECULAR FORMULA: C3H4
MOLECULAR WEIGHT: 43.082345
SMILES: [2H]C([2H])([2H])C#C
Structure:

CAS RN: 13021-15-3
CAS Name: N,N,2,4,6-pentamethylaniline
OPENEYE Name: N,N,2,4,6-pentamethylaniline
IUPAC Name: N,N,2,4,6-pentamethylaniline
SYSTEMATIC NAME: N,N,2,4,6-pentamethylaniline
MOLECULAR FORMULA: C11H17N
MOLECULAR WEIGHT: 163.25938
SMILES: CC1=CC(=C(C(=C1)C)N(C)C)C
Structure:

CAS RN: 13021-14-2
CAS Name: N,2,4,6-tetramethylaniline
OPENEYE Name: N,2,4,6-tetramethylaniline
IUPAC Name: N,2,4,6-tetramethylaniline
SYSTEMATIC NAME: N,2,4,6-tetramethylaniline
MOLECULAR FORMULA: C10H15N
MOLECULAR WEIGHT: 149.2328
SMILES: CC1=CC(=C(C(=C1)C)NC)C
Structure:

CAS RN: 13014-85-2
CAS Name: N-(trimethylsilylmethyl)ethanamine
OPENEYE Name: N-(trimethylsilylmethyl)ethanamine
IUPAC Name: N-(trimethylsilylmethyl)ethanamine
SYSTEMATIC NAME: N-(trimethylsilylmethyl)ethanamine
MOLECULAR FORMULA: C6H17NSi
MOLECULAR WEIGHT: 131.29138
SMILES: CCNC[Si](C)(C)C
Structure:

CAS RN: 13012-16-3
CAS Name: 4-(dimethylamino)-3,5-dimethylbenzonitrile
OPENEYE Name: 4-(dimethylamino)-3,5-dimethyl-benzonitrile
IUPAC Name: 4-(dimethylamino)-3,5-dimethylbenzonitrile
SYSTEMATIC NAME: 4-(dimethylamino)-3,5-dimethyl-benzenecarbonitrile
MOLECULAR FORMULA: C11H14N2
MOLECULAR WEIGHT: 174.24226
SMILES: CC1=CC(=CC(=C1N(C)C)C)C#N
Structure:

CAS RN: 13005-81-7
CAS Name: 5,5-dimethyltrithiane
OPENEYE Name: 5,5-dimethyltrithiane
IUPAC Name: 5,5-dimethyltrithiane
SYSTEMATIC NAME: 5,5-dimethyl-1,2,3-trithiane
MOLECULAR FORMULA: C5H10S3
MOLECULAR WEIGHT: 166.3279
SMILES: CC1(CSSSC1)C
Structure:

CAS RN: 13002-10-3
CAS Name: 1-(1-butoxypropoxy)butane
OPENEYE Name: 1-(1-butoxypropoxy)butane
IUPAC Name: 1-(1-butoxypropoxy)butane
SYSTEMATIC NAME: 1-(1-butoxypropoxy)butane
MOLECULAR FORMULA: C11H24O2
MOLECULAR WEIGHT: 188.30706
SMILES: CCCCOC(CC)OCCCC
Structure:

CAS RN: 88321-10-2
CAS Name: 4-(4-amino-6,7,8-trimethoxy-2-quinazolinyl)-1-piperazinecarboxylic acid (2,3-dihydroxy-2-methylpropyl) ester
OPENEYE Name: (2,3-dihydroxy-2-methyl-propyl) 4-(4-amino-6,7,8-trimethoxy-quinazolin-2-yl)piperazine-1-carboxylate
IUPAC Name: (2,3-dihydroxy-2-methylpropyl) 4-(4-amino-6,7,8-trimethoxyquinazolin-2-yl)piperazine-1-carboxylate
SYSTEMATIC NAME: [2-methyl-2,3-bis(oxidanyl)propyl] 4-(4-azanyl-6,7,8-trimethoxy-quinazolin-2-yl)piperazine-1-carboxylate
MOLECULAR FORMULA: C20H29N5O7
MOLECULAR WEIGHT: 451.47356
SMILES: CC(CO)(COC(=O)N1CCN(CC1)C2=NC3=C(C(=C(C=C3C(=N2)N)OC)OC)OC)O
Structure:

CAS RN: 12628-09-0
CAS Name: borylenemethylidenesilane
OPENEYE Name: boranylidenemethylenesilane
IUPAC Name: boranylidenemethylidenesilane
SYSTEMATIC NAME: boranylidenemethylidenesilane
MOLECULAR FORMULA: CH3BSi
MOLECULAR WEIGHT: 53.93102
SMILES: B=C=[SiH2]
Structure:

CAS RN: 12602-39-0
CAS Name: ethynylphosphine
OPENEYE Name: ethynylphosphane
IUPAC Name: ethynylphosphane
SYSTEMATIC NAME: ethynylphosphane
MOLECULAR FORMULA: C2H3P
MOLECULAR WEIGHT: 58.018981
SMILES: C#CP
Structure:

CAS RN: 88296-21-3
CAS Name: 4,4-dimethyl-1-oxo-2,3-dihydronaphthalene-2-carboxylic acid
OPENEYE Name: 4,4-dimethyl-1-oxo-tetralin-2-carboxylic acid
IUPAC Name: 4,4-dimethyl-1-oxo-2,3-dihydronaphthalene-2-carboxylic acid
SYSTEMATIC NAME: 4,4-dimethyl-1-oxidanylidene-2,3-dihydronaphthalene-2-carboxylic acid
MOLECULAR FORMULA: C13H14O3
MOLECULAR WEIGHT: 218.24846
SMILES: CC1(CC(C(=O)C2=CC=CC=C21)C(=O)O)C
Structure:

CAS RN: 12601-93-3
CAS Name: phosphinidenemethylidenephosphine
OPENEYE Name: phosphanylidenemethylenephosphane
IUPAC Name: phosphanylidenemethylidenephosphane
SYSTEMATIC NAME: phosphanylidenemethylidenephosphane
MOLECULAR FORMULA: CH2P2
MOLECULAR WEIGHT: 75.974102
SMILES: C(=P)=P
Structure:

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