Thursday, November 29, 2012

http://ChemLookup.com Compounds




CAS RN: 28882-09-9
CAS Name: bromo(difluoro)methane
OPENEYE Name: bromo(difluoro)methane
IUPAC Name: bromo(difluoro)methane
SYSTEMATIC NAME: bromanyl-bis(fluoranyl)methane
MOLECULAR FORMULA: CBrF2
MOLECULAR WEIGHT: 129.911506
SMILES: [C](F)(F)Br
Structure:

CAS RN: 28873-61-2
CAS Name: 5,5-dimethyl-1,3,4-oxadiazol-2-one
OPENEYE Name: 5,5-dimethyl-1,3,4-oxadiazol-2-one
IUPAC Name: 5,5-dimethyl-1,3,4-oxadiazol-2-one
SYSTEMATIC NAME: 5,5-dimethyl-1,3,4-oxadiazol-2-one
MOLECULAR FORMULA: C4H6N2O2
MOLECULAR WEIGHT: 114.10264
SMILES: CC1(N=NC(=O)O1)C
Structure:

CAS RN: 28844-11-3
CAS Name: difluorothorium
OPENEYE Name: difluorothorium
IUPAC Name: difluorothorium
SYSTEMATIC NAME: bis(fluoranyl)thorium
MOLECULAR FORMULA: F2Th
MOLECULAR WEIGHT: 270.034906
SMILES: F[Th]F
Structure:

CAS RN: 28834-17-5
CAS Name: 4,11,11-trimethyl-8-methylene-5-nitro-4-nitrosobicyclo[7.2.0]undecane
OPENEYE Name: 4,11,11-trimethyl-8-methylene-5-nitro-4-nitroso-bicyclo[7.2.0]undecane
IUPAC Name: 4,11,11-trimethyl-8-methylidene-5-nitro-4-nitrosobicyclo[7.2.0]undecane
SYSTEMATIC NAME: 4,11,11-trimethyl-8-methylidene-5-nitro-4-nitroso-bicyclo[7.2.0]undecane
MOLECULAR FORMULA: C15H24N2O3
MOLECULAR WEIGHT: 280.36266
SMILES: CC1(CC2C1CCC(C(CCC2=C)[N+](=O)[O-])(C)N=O)C
Structure:

CAS RN: 28820-59-9
CAS Name: 2,4,6-tris(2-fluoro-2,2-dinitroethoxy)-1,3,5-triazine
OPENEYE Name: 2,4,6-tris(2-fluoro-2,2-dinitro-ethoxy)-1,3,5-triazine
IUPAC Name: 2,4,6-tris(2-fluoro-2,2-dinitroethoxy)-1,3,5-triazine
SYSTEMATIC NAME: 2,4,6-tris(2-fluoranyl-2,2-dinitro-ethoxy)-1,3,5-triazine
MOLECULAR FORMULA: C9H6F3N9O15
MOLECULAR WEIGHT: 537.19045
SMILES: C(C([N+](=O)[O-])([N+](=O)[O-])F)OC1=NC(=NC(=N1)OCC([N+](=O)[O-])([N+](=O)[O-])F)OCC([N+](=O)[O-])([N+](=O)[O-])F
Structure:

CAS RN: 28820-56-6
CAS Name: N-(2-fluoro-2,2-dinitroethyl)-N-[2-[(2-fluoro-2,2-dinitroethyl)-nitroamino]ethyl]nitramide
OPENEYE Name: N-(2-fluoro-2,2-dinitro-ethyl)-N-[2-[(2-fluoro-2,2-dinitro-ethyl)-nitro-amino]ethyl]nitramide
IUPAC Name: N-(2-fluoro-2,2-dinitroethyl)-N-[2-[(2-fluoro-2,2-dinitroethyl)-nitroamino]ethyl]nitramide
SYSTEMATIC NAME: N-(2-fluoranyl-2,2-dinitro-ethyl)-N-[2-[(2-fluoranyl-2,2-dinitro-ethyl)-nitro-amino]ethyl]nitramide
MOLECULAR FORMULA: C6H8F2N8O12
MOLECULAR WEIGHT: 422.170926
SMILES: C(CN(CC([N+](=O)[O-])([N+](=O)[O-])F)[N+](=O)[O-])N(CC([N+](=O)[O-])([N+](=O)[O-])F)[N+](=O)[O-]
Structure:

CAS RN: 28787-21-5
CAS Name: 1-(diaminomethylidene)-3-nitrourea
OPENEYE Name: 1-(diaminomethylene)-3-nitro-urea
IUPAC Name: 1-(diaminomethylidene)-3-nitrourea
SYSTEMATIC NAME: 1-[bis(azanyl)methylidene]-3-nitro-urea
MOLECULAR FORMULA: C2H5N5O3
MOLECULAR WEIGHT: 147.0928
SMILES: C(=NC(=O)N[N+](=O)[O-])(N)N
Structure:

CAS RN: 28786-71-2
CAS Name: 3,4-ditert-butyl-1-cyclopenta-2,4-dienone
OPENEYE Name: 3,4-ditert-butylcyclopenta-2,4-dien-1-one
IUPAC Name: 3,4-ditert-butylcyclopenta-2,4-dien-1-one
SYSTEMATIC NAME: 3,4-ditert-butylcyclopenta-2,4-dien-1-one
MOLECULAR FORMULA: C13H20O
MOLECULAR WEIGHT: 192.2973
SMILES: CC(C)(C)C1=CC(=O)C=C1C(C)(C)C
Structure:

CAS RN: 28752-81-0
CAS Name: bis(3-thiophenyl)mercury
OPENEYE Name: bis(3-thienyl)mercury
IUPAC Name: di(thiophen-3-yl)mercury
SYSTEMATIC NAME: di(thiophen-3-yl)mercury
MOLECULAR FORMULA: C8H6HgS2
MOLECULAR WEIGHT: 366.85324
SMILES: C1=CSC=C1[Hg]C2=CSC=C2
Structure:

CAS RN: 28752-80-9
CAS Name: bis(3-furanyl)mercury
OPENEYE Name: bis(3-furyl)mercury
IUPAC Name: bis(furan-3-yl)mercury
SYSTEMATIC NAME: bis(furan-3-yl)mercury
MOLECULAR FORMULA: C8H6HgO2
MOLECULAR WEIGHT: 334.72204
SMILES: C1=COC=C1[Hg]C2=COC=C2
Structure:

CAS RN: 28752-79-6
CAS Name: bis(2-furanyl)mercury
OPENEYE Name: bis(2-furyl)mercury
IUPAC Name: bis(furan-2-yl)mercury
SYSTEMATIC NAME: bis(furan-2-yl)mercury
MOLECULAR FORMULA: C8H6HgO2
MOLECULAR WEIGHT: 334.72204
SMILES: C1=COC(=C1)[Hg]C2=CC=CO2
Structure:

CAS RN: 28752-34-3
CAS Name: 2-[4-(dimethylamino)phenyl]-1-(4-nitrophenyl)-1-cyclopropanecarbonitrile
OPENEYE Name: 2-[4-(dimethylamino)phenyl]-1-(4-nitrophenyl)cyclopropanecarbonitrile
IUPAC Name: 2-[4-(dimethylamino)phenyl]-1-(4-nitrophenyl)cyclopropane-1-carbonitrile
SYSTEMATIC NAME: 2-[4-(dimethylamino)phenyl]-1-(4-nitrophenyl)cyclopropane-1-carbonitrile
MOLECULAR FORMULA: C18H17N3O2
MOLECULAR WEIGHT: 307.34648
SMILES: CN(C)C1=CC=C(C=C1)C2CC2(C#N)C3=CC=C(C=C3)[N+](=O)[O-]
Structure:

CAS RN: 28752-28-5
CAS Name: 1,2-bis(4-nitrophenyl)-1-cyclopropanecarbonitrile
OPENEYE Name: 1,2-bis(4-nitrophenyl)cyclopropanecarbonitrile
IUPAC Name: 1,2-bis(4-nitrophenyl)cyclopropane-1-carbonitrile
SYSTEMATIC NAME: 1,2-bis(4-nitrophenyl)cyclopropane-1-carbonitrile
MOLECULAR FORMULA: C16H11N3O4
MOLECULAR WEIGHT: 309.27624
SMILES: C1C(C1(C#N)C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=C(C=C3)[N+](=O)[O-]
Structure:

CAS RN: 28734-87-4
CAS Name: 2,4,5,6,7,8-hexafluoroquinazoline
OPENEYE Name: 2,4,5,6,7,8-hexafluoroquinazoline
IUPAC Name: 2,4,5,6,7,8-hexafluoroquinazoline
SYSTEMATIC NAME: 2,4,5,6,7,8-hexakis(fluoranyl)quinazoline
MOLECULAR FORMULA: C8F6N2
MOLECULAR WEIGHT: 238.089419
SMILES: C12=C(C(=C(C(=C1F)F)F)F)N=C(N=C2F)F
Structure:

CAS RN: 28734-86-3
CAS Name: 3,4,5,6,7,8-hexafluorocinnoline
OPENEYE Name: 3,4,5,6,7,8-hexafluorocinnoline
IUPAC Name: 3,4,5,6,7,8-hexafluorocinnoline
SYSTEMATIC NAME: 3,4,5,6,7,8-hexakis(fluoranyl)cinnoline
MOLECULAR FORMULA: C8F6N2
MOLECULAR WEIGHT: 238.089419
SMILES: C12=C(C(=C(C(=C1F)F)F)F)N=NC(=C2F)F
Structure:

CAS RN: 28660-45-9
CAS Name: 10-phenylacridarsine
OPENEYE Name: 10-phenylacridarsine
IUPAC Name: 10-phenylacridarsine
SYSTEMATIC NAME: 10-phenylacridarsine
MOLECULAR FORMULA: C19H13As
MOLECULAR WEIGHT: 316.22812
SMILES: C1=CC=C(C=C1)C2=C3C=CC=CC3=[As]C4=CC=CC=C42
Structure:

CAS RN: 28648-89-7
CAS Name: 4-(5-pyrimidinyl)pyrimidine
OPENEYE Name: 4-pyrimidin-5-ylpyrimidine
IUPAC Name: 4-pyrimidin-5-ylpyrimidine
SYSTEMATIC NAME: 4-pyrimidin-5-ylpyrimidine
MOLECULAR FORMULA: C8H6N4
MOLECULAR WEIGHT: 158.16004
SMILES: C1=CN=CN=C1C2=CN=CN=C2
Structure:

CAS RN: 28638-29-1
CAS Name: 2,3,4-trimethyl-5-hexen-3-ol
OPENEYE Name: 2,3,4-trimethylhex-5-en-3-ol
IUPAC Name: 2,3,4-trimethylhex-5-en-3-ol
SYSTEMATIC NAME: 2,3,4-trimethylhex-5-en-3-ol
MOLECULAR FORMULA: C9H18O
MOLECULAR WEIGHT: 142.23862
SMILES: CC(C)C(C)(C(C)C=C)O
Structure:

CAS RN: 28623-31-6
CAS Name: N,N-di(propan-2-yl)-1,3,2-dioxaphospholan-2-amine
OPENEYE Name: N,N-diisopropyl-1,3,2-dioxaphospholan-2-amine
IUPAC Name: N,N-di(propan-2-yl)-1,3,2-dioxaphospholan-2-amine
SYSTEMATIC NAME: N,N-di(propan-2-yl)-1,3,2-dioxaphospholan-2-amine
MOLECULAR FORMULA: C8H18NO2P
MOLECULAR WEIGHT: 191.207781
SMILES: CC(C)N(C(C)C)P1OCCO1
Structure:

CAS RN: 28512-55-2
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C28H16
MOLECULAR WEIGHT: 352.42664
SMILES: C1=CC=C2C=C3C(=CC2=C1)C=CC4=C3C5=CC=CC6=C5C4=CC7=CC=CC=C67
Structure:

CAS RN: 28504-86-1
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C8H4O2S3
MOLECULAR WEIGHT: 228.31116
SMILES: C1=CSC2=C1C3=C(S2(=O)=O)SC=C3
Structure:

CAS RN: 28504-85-0
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C8H4O2S3
MOLECULAR WEIGHT: 228.31116
SMILES: C1=C2C3=CSC=C3S(=O)(=O)C2=CS1
Structure:

CAS RN: 28504-81-6
CAS Name: 3-bromo-4-[(4-bromo-3-thiophenyl)thio]thiophene
OPENEYE Name: 3-bromo-4-[(4-bromo-3-thienyl)sulfanyl]thiophene
IUPAC Name: 3-bromo-4-(4-bromothiophen-3-yl)sulfanylthiophene
SYSTEMATIC NAME: 3-bromanyl-4-(4-bromanylthiophen-3-yl)sulfanyl-thiophene
MOLECULAR FORMULA: C8H4Br2S3
MOLECULAR WEIGHT: 356.12036
SMILES: C1=C(C(=CS1)Br)SC2=CSC=C2Br
Structure:

CAS RN: 28504-80-5
CAS Name: 3-bromo-2-[(3-bromo-2-thiophenyl)thio]thiophene
OPENEYE Name: 3-bromo-2-[(3-bromo-2-thienyl)sulfanyl]thiophene
IUPAC Name: 3-bromo-2-(3-bromothiophen-2-yl)sulfanylthiophene
SYSTEMATIC NAME: 3-bromanyl-2-(3-bromanylthiophen-2-yl)sulfanyl-thiophene
MOLECULAR FORMULA: C8H4Br2S3
MOLECULAR WEIGHT: 356.12036
SMILES: C1=CSC(=C1Br)SC2=C(C=CS2)Br
Structure:

CAS RN: 28495-27-4
CAS Name: 1-propan-2-yloxycyclohexa-1,4-diene
OPENEYE Name: 1-isopropoxycyclohexa-1,4-diene
IUPAC Name: 1-propan-2-yloxycyclohexa-1,4-diene
SYSTEMATIC NAME: 1-propan-2-yloxycyclohexa-1,4-diene
MOLECULAR FORMULA: C9H14O
MOLECULAR WEIGHT: 138.20686
SMILES: CC(C)OC1=CCC=CC1
Structure:

CAS RN: 28493-54-1
CAS Name: tributyl-(phenylmethyl)stannane
OPENEYE Name: benzyl(tributyl)stannane
IUPAC Name: benzyl(tributyl)stannane
SYSTEMATIC NAME: tributyl-(phenylmethyl)stannane
MOLECULAR FORMULA: C19H34Sn
MOLECULAR WEIGHT: 381.18326
SMILES: CCCC[Sn](CCCC)(CCCC)CC1=CC=CC=C1
Structure:

CAS RN: 28479-19-8
CAS Name: 1-isocyanato-3-(methylthio)benzene
OPENEYE Name: 1-isocyanato-3-methylsulfanyl-benzene
IUPAC Name: 1-isocyanato-3-methylsulfanylbenzene
SYSTEMATIC NAME: 1-isocyanato-3-methylsulfanyl-benzene
MOLECULAR FORMULA: C8H7NOS
MOLECULAR WEIGHT: 165.21228
SMILES: CSC1=CC=CC(=C1)N=C=O
Structure:

CAS RN: 28467-75-6
CAS Name: 2-tridecyne
OPENEYE Name: tridec-2-yne
IUPAC Name: tridec-2-yne
SYSTEMATIC NAME: tridec-2-yne
MOLECULAR FORMULA: C13H24
MOLECULAR WEIGHT: 180.32966
SMILES: CCCCCCCCCCC#CC
Structure:

CAS RN: 28464-26-8
CAS Name: N,N-bis(2,2-dinitropropyl)nitrous amide
OPENEYE Name: N,N-bis(2,2-dinitropropyl)nitrous amide
IUPAC Name: N,N-bis(2,2-dinitropropyl)nitrous amide
SYSTEMATIC NAME: N,N-bis(2,2-dinitropropyl)nitrous amide
MOLECULAR FORMULA: C6H10N6O9
MOLECULAR WEIGHT: 310.1784
SMILES: CC(CN(CC(C)([N+](=O)[O-])[N+](=O)[O-])N=O)([N+](=O)[O-])[N+](=O)[O-]
Structure:

CAS RN: 28464-24-6
CAS Name: N,N-bis(2,2-dinitropropyl)nitramide
OPENEYE Name: N,N-bis(2,2-dinitropropyl)nitramide
IUPAC Name: N,N-bis(2,2-dinitropropyl)nitramide
SYSTEMATIC NAME: N,N-bis(2,2-dinitropropyl)nitramide
MOLECULAR FORMULA: C6H10N6O10
MOLECULAR WEIGHT: 326.1778
SMILES: CC(CN(CC(C)([N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-]
Structure:

CAS RN: 28453-24-9
CAS Name: 2,4,5,7-tetranitro-9H-carbazole
OPENEYE Name: 2,4,5,7-tetranitro-9H-carbazole
IUPAC Name: 2,4,5,7-tetranitro-9H-carbazole
SYSTEMATIC NAME: 2,4,5,7-tetranitro-9H-carbazole
MOLECULAR FORMULA: C12H5N5O8
MOLECULAR WEIGHT: 347.1968
SMILES: C1=C(C=C2C(=C1[N+](=O)[O-])C3=C(C=C(C=C3N2)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]
Structure:

CAS RN: 28450-02-4
CAS Name: 1-(6-methyl-3,4-dihydro-2H-pyran-2-yl)ethanone
OPENEYE Name: 1-(6-methyl-3,4-dihydro-2H-pyran-2-yl)ethanone
IUPAC Name: 1-(6-methyl-3,4-dihydro-2H-pyran-2-yl)ethanone
SYSTEMATIC NAME: 1-(6-methyl-3,4-dihydro-2H-pyran-2-yl)ethanone
MOLECULAR FORMULA: C8H12O2
MOLECULAR WEIGHT: 140.17968
SMILES: CC1=CCCC(O1)C(=O)C
Structure:

CAS RN: 28438-32-6
CAS Name: 1,1-dimethyl-2-(2-methylprop-1-enylidene)cyclopropane
OPENEYE Name: 1,1-dimethyl-2-(2-methylprop-1-enylidene)cyclopropane
IUPAC Name: 1,1-dimethyl-2-(2-methylprop-1-enylidene)cyclopropane
SYSTEMATIC NAME: 1,1-dimethyl-2-(2-methylprop-1-enylidene)cyclopropane
MOLECULAR FORMULA: C9H14
MOLECULAR WEIGHT: 122.20746
SMILES: CC(=C=C1CC1(C)C)C
Structure:

CAS RN: 28375-86-2
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C15H22
MOLECULAR WEIGHT: 202.33518
SMILES: CC1C2CC3C4CC5CC3C1C(C5)C4C2
Structure:

CAS RN: 28341-53-9
CAS Name: 4-(4-nitrophenoxy)butanoic acid methyl ester
OPENEYE Name: methyl 4-(4-nitrophenoxy)butanoate
IUPAC Name: methyl 4-(4-nitrophenoxy)butanoate
SYSTEMATIC NAME: methyl 4-(4-nitrophenoxy)butanoate
MOLECULAR FORMULA: C11H13NO5
MOLECULAR WEIGHT: 239.22462
SMILES: COC(=O)CCCOC1=CC=C(C=C1)[N+](=O)[O-]
Structure:

CAS RN: 28338-70-7
CAS Name: (9S,14S)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,5,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene
OPENEYE Name: (9S,14S)-17-[(1R)-1,5-dimethylhexyl]-10,13-dimethyl-2,3,4,5,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene
IUPAC Name: (9S,14S)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,5,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene
SYSTEMATIC NAME: (9S,14S)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,5,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene
MOLECULAR FORMULA: C27H46
MOLECULAR WEIGHT: 370.65414
SMILES: C[C@H](CCCC(C)C)C1CC[C@@H]2C1(CC[C@H]3C2C=CC4C3(CCCC4)C)C
Structure:

CAS RN: 28308-02-3
CAS Name: bromo(tributylphosphoranylidene)cobalt; nitroxyl anion
OPENEYE Name: bromo-(tributyl-$l^{5}-phosphanylidene)cobalt; nitroxyl anion
IUPAC Name: bromo-(tributyl-$l^{5}-phosphanylidene)cobalt; nitroxyl anion
SYSTEMATIC NAME: bromanyl-(tributyl-$l^{5}-phosphanylidene)cobalt; oxoazanide
MOLECULAR FORMULA: C12H27BrCoN2O2P-2
MOLECULAR WEIGHT: 401.165941
SMILES: CCCCP(=[Co]Br)(CCCC)CCCC.[N-]=O.[N-]=O
Structure:

CAS RN: 28255-97-2
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C18H16
MOLECULAR WEIGHT: 232.31964
SMILES: C1CC2C3=CC=CC=C2C=C4C1C(=C3)C=CC=C4
Structure:

CAS RN: 28192-05-4
CAS Name: 1-(4-chlorophenyl)aziridine
OPENEYE Name: 1-(4-chlorophenyl)aziridine
IUPAC Name: 1-(4-chlorophenyl)aziridine
SYSTEMATIC NAME: 1-(4-chlorophenyl)aziridine
MOLECULAR FORMULA: C8H8ClN
MOLECULAR WEIGHT: 153.60882
SMILES: C1CN1C2=CC=C(C=C2)Cl
Structure:

No comments:

Post a Comment