Thursday, November 29, 2012

http://ChemLookup.com Compounds




CAS RN: 26120-52-5
CAS Name: 1,4-dimethylcyclohexa-1,3-diene
OPENEYE Name: 1,4-dimethylcyclohexa-1,3-diene
IUPAC Name: 1,4-dimethylcyclohexa-1,3-diene
SYSTEMATIC NAME: 1,4-dimethylcyclohexa-1,3-diene
MOLECULAR FORMULA: C8H12
MOLECULAR WEIGHT: 108.18088
SMILES: CC1=CC=C(CC1)C
Structure:

CAS RN: 26107-80-2
CAS Name: 3,5-bis(trifluoromethyl)benzoic acid methyl ester
OPENEYE Name: methyl 3,5-bis(trifluoromethyl)benzoate
IUPAC Name: methyl 3,5-bis(trifluoromethyl)benzoate
SYSTEMATIC NAME: methyl 3,5-bis(trifluoromethyl)benzoate
MOLECULAR FORMULA: C10H6F6O2
MOLECULAR WEIGHT: 272.143859
SMILES: COC(=O)C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F
Structure:

CAS RN: 26105-63-5
CAS Name: (ethylditellanyl)ethane
OPENEYE Name: (ethylditellanyl)ethane
IUPAC Name: (ethylditellanyl)ethane
SYSTEMATIC NAME: (ethylditellanyl)ethane
MOLECULAR FORMULA: C4H10Te2
MOLECULAR WEIGHT: 313.3222
SMILES: CC[Te][Te]CC
Structure:

CAS RN: 26081-83-4
CAS Name: 6-oxido-7-aza-6-azoniabicyclo[3.2.2]non-6-ene
OPENEYE Name: 6-oxido-7-aza-6-azoniabicyclo[3.2.2]non-6-ene
IUPAC Name: 6-oxido-7-aza-6-azoniabicyclo[3.2.2]non-6-ene
SYSTEMATIC NAME: 6-oxidanidyl-7-aza-6-azoniabicyclo[3.2.2]non-6-ene
MOLECULAR FORMULA: C7H12N2O
MOLECULAR WEIGHT: 140.18298
SMILES: C1CC2CCC(C1)[N+](=N2)[O-]
Structure:

CAS RN: 26059-43-8
CAS Name: 3-heptyn-2-one
OPENEYE Name: hept-3-yn-2-one
IUPAC Name: hept-3-yn-2-one
SYSTEMATIC NAME: hept-3-yn-2-one
MOLECULAR FORMULA: C7H10O
MOLECULAR WEIGHT: 110.1537
SMILES: CCCC#CC(=O)C
Structure:

CAS RN: 26050-79-3
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C16H20
MOLECULAR WEIGHT: 212.33
SMILES: C1CC2=CCC(=CC2)CCC3=CCC1=CC3
Structure:

CAS RN: 25959-51-7
CAS Name: 1-(4-hexoxyphenyl)-N-(4-methylphenyl)methanimine
OPENEYE Name: 1-(4-hexoxyphenyl)-N-(p-tolyl)methanimine
IUPAC Name: 1-(4-hexoxyphenyl)-N-(4-methylphenyl)methanimine
SYSTEMATIC NAME: 1-(4-hexoxyphenyl)-N-(4-methylphenyl)methanimine
MOLECULAR FORMULA: C20H25NO
MOLECULAR WEIGHT: 295.4186
SMILES: CCCCCCOC1=CC=C(C=C1)C=NC2=CC=C(C=C2)C
Structure:

CAS RN: 25959-36-8
CAS Name: 1,1-dimethyl-2,4,6-triphenyl-1$l^{5}-phosphacyclohexa-1,3,5-triene
OPENEYE Name: 1,1-dimethyl-2,4,6-triphenyl-1$l^{5}-phosphacyclohexa-1,3,5-triene
IUPAC Name: 1,1-dimethyl-2,4,6-triphenyl-1$l^{5}-phosphacyclohexa-1,3,5-triene
SYSTEMATIC NAME: 1,1-dimethyl-2,4,6-triphenyl-1$l^{5}-phosphacyclohexa-1,3,5-triene
MOLECULAR FORMULA: C25H23P
MOLECULAR WEIGHT: 354.423881
SMILES: CP1(=C(C=C(C=C1C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4)C
Structure:

CAS RN: 25948-13-4
CAS Name: N-(3-methoxypropyl)-5-nitro-2-pyridinamine
OPENEYE Name: N-(3-methoxypropyl)-5-nitro-pyridin-2-amine
IUPAC Name: N-(3-methoxypropyl)-5-nitropyridin-2-amine
SYSTEMATIC NAME: N-(3-methoxypropyl)-5-nitro-pyridin-2-amine
MOLECULAR FORMULA: C9H13N3O3
MOLECULAR WEIGHT: 211.21782
SMILES: COCCCNC1=NC=C(C=C1)[N+](=O)[O-]
Structure:

CAS RN: 25926-99-2
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C7H10N2O
MOLECULAR WEIGHT: 138.1671
SMILES: C1CC2C3CC3C1N=[N+]2[O-]
Structure:

CAS RN: 25926-97-0
CAS Name: 7-oxido-8-aza-7-azoniabicyclo[4.2.2]dec-7-ene
OPENEYE Name: 7-oxido-8-aza-7-azoniabicyclo[4.2.2]dec-7-ene
IUPAC Name: 7-oxido-8-aza-7-azoniabicyclo[4.2.2]dec-7-ene
SYSTEMATIC NAME: 7-oxidanidyl-8-aza-7-azoniabicyclo[4.2.2]dec-7-ene
MOLECULAR FORMULA: C8H14N2O
MOLECULAR WEIGHT: 154.20956
SMILES: C1CCC2CCC(C1)N=[N+]2[O-]
Structure:

CAS RN: 25926-96-9
CAS Name: 3-oxido-2-aza-3-azoniabicyclo[2.2.2]oct-2-ene
OPENEYE Name: 3-oxido-2-aza-3-azoniabicyclo[2.2.2]oct-2-ene
IUPAC Name: 3-oxido-2-aza-3-azoniabicyclo[2.2.2]oct-2-ene
SYSTEMATIC NAME: 3-oxidanidyl-2-aza-3-azoniabicyclo[2.2.2]oct-2-ene
MOLECULAR FORMULA: C6H10N2O
MOLECULAR WEIGHT: 126.1564
SMILES: C1CC2CCC1N=[N+]2[O-]
Structure:

CAS RN: 25925-00-2
CAS Name: 2,5-di(propan-2-yl)-1,3-dioxane
OPENEYE Name: 2,5-diisopropyl-1,3-dioxane
IUPAC Name: 2,5-di(propan-2-yl)-1,3-dioxane
SYSTEMATIC NAME: 2,5-di(propan-2-yl)-1,3-dioxane
MOLECULAR FORMULA: C10H20O2
MOLECULAR WEIGHT: 172.2646
SMILES: CC(C)C1COC(OC1)C(C)C
Structure:

CAS RN: 25925-01-3
CAS Name: 2,5-di(propan-2-yl)-1,3-dioxane
OPENEYE Name: 2,5-diisopropyl-1,3-dioxane
IUPAC Name: 2,5-di(propan-2-yl)-1,3-dioxane
SYSTEMATIC NAME: 2,5-di(propan-2-yl)-1,3-dioxane
MOLECULAR FORMULA: C10H20O2
MOLECULAR WEIGHT: 172.2646
SMILES: CC(C)C1COC(OC1)C(C)C
Structure:

CAS RN: 25924-90-7
CAS Name: 5-ethyl-2-methyl-1,3-dioxane
OPENEYE Name: 5-ethyl-2-methyl-1,3-dioxane
IUPAC Name: 5-ethyl-2-methyl-1,3-dioxane
SYSTEMATIC NAME: 5-ethyl-2-methyl-1,3-dioxane
MOLECULAR FORMULA: C7H14O2
MOLECULAR WEIGHT: 130.18486
SMILES: CCC1COC(OC1)C
Structure:

CAS RN: 25924-91-8
CAS Name: 5-ethyl-2-methyl-1,3-dioxane
OPENEYE Name: 5-ethyl-2-methyl-1,3-dioxane
IUPAC Name: 5-ethyl-2-methyl-1,3-dioxane
SYSTEMATIC NAME: 5-ethyl-2-methyl-1,3-dioxane
MOLECULAR FORMULA: C7H14O2
MOLECULAR WEIGHT: 130.18486
SMILES: CCC1COC(OC1)C
Structure:

CAS RN: 25894-11-5
CAS Name: 4-ethenyl-3,5-dimethyl-1H-pyrrole-2-carboxylic acid ethyl ester
OPENEYE Name: ethyl 3,5-dimethyl-4-vinyl-1H-pyrrole-2-carboxylate
IUPAC Name: ethyl 4-ethenyl-3,5-dimethyl-1H-pyrrole-2-carboxylate
SYSTEMATIC NAME: ethyl 4-ethenyl-3,5-dimethyl-1H-pyrrole-2-carboxylate
MOLECULAR FORMULA: C11H15NO2
MOLECULAR WEIGHT: 193.2423
SMILES: CCOC(=O)C1=C(C(=C(N1)C)C=C)C
Structure:

CAS RN: 25871-69-6
CAS Name: (3,5-dibenzoylphenyl)-phenylmethanone
OPENEYE Name: (3,5-dibenzoylphenyl)-phenyl-methanone
IUPAC Name: (3,5-dibenzoylphenyl)-phenylmethanone
SYSTEMATIC NAME: [3,5-bis(phenylcarbonyl)phenyl]-phenyl-methanone
MOLECULAR FORMULA: C27H18O3
MOLECULAR WEIGHT: 390.43002
SMILES: C1=CC=C(C=C1)C(=O)C2=CC(=CC(=C2)C(=O)C3=CC=CC=C3)C(=O)C4=CC=CC=C4
Structure:

CAS RN: 25863-08-5
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C8H12N2
MOLECULAR WEIGHT: 136.19428
SMILES: C1CC2C1C3CCC2N=N3
Structure:

CAS RN: 25840-11-3
CAS Name: propanenitrile
OPENEYE Name: propanenitrile
IUPAC Name: propanenitrile
SYSTEMATIC NAME: propanenitrile
MOLECULAR FORMULA: C3H4N
MOLECULAR WEIGHT: 54.07056
SMILES: [CH2]CC#N
Structure:

CAS RN: 25835-57-8
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C17H14
MOLECULAR WEIGHT: 218.29306
SMILES: C1C2C3=CC4=CC=CC=C(C41)C=C2C=CC=C3
Structure:

CAS RN: 25829-64-5
CAS Name: 2-[6-[[2-(2-aminophenyl)-3H-benzimidazol-5-yl]oxy]-1H-benzimidazol-2-yl]aniline
OPENEYE Name: 2-[6-[[2-(2-aminophenyl)-3H-benzimidazol-5-yl]oxy]-1H-benzimidazol-2-yl]aniline
IUPAC Name: 2-[6-[[2-(2-aminophenyl)-3H-benzimidazol-5-yl]oxy]-1H-benzimidazol-2-yl]aniline
SYSTEMATIC NAME: 2-[6-[[2-(2-aminophenyl)-3H-benzimidazol-5-yl]oxy]-1H-benzimidazol-2-yl]aniline
MOLECULAR FORMULA: C26H20N6O
MOLECULAR WEIGHT: 432.4766
SMILES: C1=CC=C(C(=C1)C2=NC3=C(N2)C=C(C=C3)OC4=CC5=C(C=C4)N=C(N5)C6=CC=CC=C6N)N
Structure:

CAS RN: 25811-66-9
CAS Name: tert-butyl(trimethylsilyl)diazene
OPENEYE Name: tert-butyl(trimethylsilyl)diazene
IUPAC Name: tert-butyl(trimethylsilyl)diazene
SYSTEMATIC NAME: tert-butyl(trimethylsilyl)diazene
MOLECULAR FORMULA: C7H18N2Si
MOLECULAR WEIGHT: 158.31672
SMILES: CC(C)(C)N=N[Si](C)(C)C
Structure:

CAS RN: 25804-89-1
CAS Name: 7-chloro-N,N-dimethyl-4H-1,3-benzoxazin-4-amine
OPENEYE Name: 7-chloro-N,N-dimethyl-4H-1,3-benzoxazin-4-amine
IUPAC Name: 7-chloro-N,N-dimethyl-4H-1,3-benzoxazin-4-amine
SYSTEMATIC NAME: 7-chloranyl-N,N-dimethyl-4H-1,3-benzoxazin-4-amine
MOLECULAR FORMULA: C10H11ClN2O
MOLECULAR WEIGHT: 210.66014
SMILES: CN(C)C1C2=C(C=C(C=C2)Cl)OC=N1
Structure:

CAS RN: 25783-45-3
CAS Name: 1-ethoxy-3-methoxybenzene
OPENEYE Name: 1-ethoxy-3-methoxy-benzene
IUPAC Name: 1-ethoxy-3-methoxybenzene
SYSTEMATIC NAME: 1-ethoxy-3-methoxy-benzene
MOLECULAR FORMULA: C9H12O2
MOLECULAR WEIGHT: 152.19038
SMILES: CCOC1=CC=CC(=C1)OC
Structure:

CAS RN: 25771-21-5
CAS Name: N,N-dimethyl-4-(trifluoromethyl)benzamide
OPENEYE Name: N,N-dimethyl-4-(trifluoromethyl)benzamide
IUPAC Name: N,N-dimethyl-4-(trifluoromethyl)benzamide
SYSTEMATIC NAME: N,N-dimethyl-4-(trifluoromethyl)benzamide
MOLECULAR FORMULA: C10H10F3NO
MOLECULAR WEIGHT: 217.18771
SMILES: CN(C)C(=O)C1=CC=C(C=C1)C(F)(F)F
Structure:

CAS RN: 25757-74-8
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: F2H2NP
MOLECULAR WEIGHT: 84.993147
SMILES: NP(F)F
Structure:

CAS RN: 25732-35-8
CAS Name: 1,4,5,6,7,8-hexafluorophthalazine
OPENEYE Name: 1,4,5,6,7,8-hexafluorophthalazine
IUPAC Name: 1,4,5,6,7,8-hexafluorophthalazine
SYSTEMATIC NAME: 1,4,5,6,7,8-hexakis(fluoranyl)phthalazine
MOLECULAR FORMULA: C8F6N2
MOLECULAR WEIGHT: 238.089419
SMILES: C12=C(C(=C(C(=C1F)F)F)F)C(=NN=C2F)F
Structure:

CAS RN: 25730-47-6
CAS Name: 4,6-diphenyl-1$l^{4},2,8-trithiabicyclo[3.3.0]octa-1(5),3,6-triene
OPENEYE Name: 4,6-diphenyl-1$l^{4},2,8-trithiabicyclo[3.3.0]octa-1(5),3,6-triene
IUPAC Name: 4,6-diphenyl-1$l^{4},2,8-trithiabicyclo[3.3.0]octa-1(5),3,6-triene
SYSTEMATIC NAME: 4,6-diphenyl-1$l^{4},2,8-trithiabicyclo[3.3.0]octa-1(5),3,6-triene
MOLECULAR FORMULA: C17H12S3
MOLECULAR WEIGHT: 312.47218
SMILES: C1=CC=C(C=C1)C2=CSS3=C2C(=CS3)C4=CC=CC=C4
Structure:

CAS RN: 25697-55-6
CAS Name: [3-(trifluoromethyl)phenyl]methanethiol
OPENEYE Name: [3-(trifluoromethyl)phenyl]methanethiol
IUPAC Name: [3-(trifluoromethyl)phenyl]methanethiol
SYSTEMATIC NAME: [3-(trifluoromethyl)phenyl]methanethiol
MOLECULAR FORMULA: C8H7F3S
MOLECULAR WEIGHT: 192.20139
SMILES: C1=CC(=CC(=C1)C(F)(F)F)CS
Structure:

CAS RN: 25694-16-0
CAS Name: 2-(2-adamantyl)-2-cyanoacetic acid ethyl ester
OPENEYE Name: ethyl 2-(2-adamantyl)-2-cyano-acetate
IUPAC Name: ethyl 2-(2-adamantyl)-2-cyanoacetate
SYSTEMATIC NAME: ethyl 2-(2-adamantyl)-2-cyano-ethanoate
MOLECULAR FORMULA: C15H21NO2
MOLECULAR WEIGHT: 247.33274
SMILES: CCOC(=O)C(C#N)C1C2CC3CC(C2)CC1C3
Structure:

CAS RN: 25688-42-0
CAS Name: tris[2-(trifluoromethyl)phenyl]phosphine
OPENEYE Name: tris[2-(trifluoromethyl)phenyl]phosphane
IUPAC Name: tris[2-(trifluoromethyl)phenyl]phosphane
SYSTEMATIC NAME: tris[2-(trifluoromethyl)phenyl]phosphane
MOLECULAR FORMULA: C21H12F9P
MOLECULAR WEIGHT: 466.27937
SMILES: C1=CC=C(C(=C1)C(F)(F)F)P(C2=CC=CC=C2C(F)(F)F)C3=CC=CC=C3C(F)(F)F
Structure:

CAS RN: 25681-79-2
CAS Name: sodiosodium
OPENEYE Name: sodiosodium
IUPAC Name: sodiosodium
SYSTEMATIC NAME: sodiosodium
MOLECULAR FORMULA: Na2
MOLECULAR WEIGHT: 45.97954
SMILES: [Na][Na]
Structure:

CAS RN: 25660-64-4
CAS Name: 4-phenylselenadiazole
OPENEYE Name: 4-phenylselenadiazole
IUPAC Name: 4-phenylselenadiazole
SYSTEMATIC NAME: 4-phenyl-1,2,3-selenadiazole
MOLECULAR FORMULA: C8H6N2Se
MOLECULAR WEIGHT: 209.10664
SMILES: C1=CC=C(C=C1)C2=C[Se]N=N2
Structure:

CAS RN: 25633-57-2
CAS Name: 3-(2-methoxy-5-methylphenyl)-2,5-dimethylbenzofuran
OPENEYE Name: 3-(2-methoxy-5-methyl-phenyl)-2,5-dimethyl-benzofuran
IUPAC Name: 3-(2-methoxy-5-methylphenyl)-2,5-dimethyl-1-benzofuran
SYSTEMATIC NAME: 3-(2-methoxy-5-methyl-phenyl)-2,5-dimethyl-1-benzofuran
MOLECULAR FORMULA: C18H18O2
MOLECULAR WEIGHT: 266.33432
SMILES: CC1=CC2=C(C=C1)OC(=C2C3=C(C=CC(=C3)C)OC)C
Structure:

CAS RN: 25604-71-1
CAS Name: 1-chloro-2-iodoethyne
OPENEYE Name: 1-chloro-2-iodo-acetylene
IUPAC Name: 1-chloro-2-iodoethyne
SYSTEMATIC NAME: 1-chloranyl-2-iodanyl-ethyne
MOLECULAR FORMULA: C2ClI
MOLECULAR WEIGHT: 186.37887
SMILES: C(#CI)Cl
Structure:

CAS RN: 25604-70-0
CAS Name: 1-bromo-2-chloroethyne
OPENEYE Name: 1-bromo-2-chloro-acetylene
IUPAC Name: 1-bromo-2-chloroethyne
SYSTEMATIC NAME: 1-bromanyl-2-chloranyl-ethyne
MOLECULAR FORMULA: C2BrCl
MOLECULAR WEIGHT: 139.3784
SMILES: C(#CBr)Cl
Structure:

CAS RN: 25604-63-1
CAS Name: [ethoxy-(ethylthio)methoxy]ethane
OPENEYE Name: [ethoxy(ethylsulfanyl)methoxy]ethane
IUPAC Name: [ethoxy(ethylsulfanyl)methoxy]ethane
SYSTEMATIC NAME: [ethoxy(ethylsulfanyl)methoxy]ethane
MOLECULAR FORMULA: C7H16O2S
MOLECULAR WEIGHT: 164.26574
SMILES: CCOC(OCC)SCC
Structure:

CAS RN: 25603-67-2
CAS Name: 9-phenyl-9-fluorenol
OPENEYE Name: 9-phenylfluoren-9-ol
IUPAC Name: 9-phenylfluoren-9-ol
SYSTEMATIC NAME: 9-phenylfluoren-9-ol
MOLECULAR FORMULA: C19H14O
MOLECULAR WEIGHT: 258.31386
SMILES: C1=CC=C(C=C1)C2(C3=CC=CC=C3C4=CC=CC=C42)O
Structure:

CAS RN: 406-10-0
CAS Name: 4,4,4-trifluoro-2-butenoic acid ethyl ester
OPENEYE Name: ethyl 4,4,4-trifluorobut-2-enoate
IUPAC Name: ethyl 4,4,4-trifluorobut-2-enoate
SYSTEMATIC NAME: ethyl 4,4,4-tris(fluoranyl)but-2-enoate
MOLECULAR FORMULA: C6H7F3O2
MOLECULAR WEIGHT: 168.11379
SMILES: CCOC(=O)C=CC(F)(F)F
Structure:

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