CAS RN: 562-46-9
CAS Name: 4,4-dimethylcyclohexane-1,3-dione
OPENEYE Name: 4,4-dimethylcyclohexane-1,3-dione
IUPAC Name: 4,4-dimethylcyclohexane-1,3-dione
SYSTEMATIC NAME: 4,4-dimethylcyclohexane-1,3-dione
MOLECULAR FORMULA: C8H12O2
MOLECULAR WEIGHT: 140.17968
SMILES: CC1(CCC(=O)CC1=O)C
Structure:
CAS RN: 558-64-5
CAS Name: 1,1,2,2,3,3,4,4,5,5,6-undecafluoro-6-(1,2,2,3,3,4,4,5,5,6,6-undecafluorocyclohexyl)cyclohexane
OPENEYE Name: 1,1,2,2,3,3,4,4,5,5,6-undecafluoro-6-(1,2,2,3,3,4,4,5,5,6,6-undecafluorocyclohexyl)cyclohexane
IUPAC Name: 1,1,2,2,3,3,4,4,5,5,6-undecafluoro-6-(1,2,2,3,3,4,4,5,5,6,6-undecafluorocyclohexyl)cyclohexane
SYSTEMATIC NAME: 1,1,2,2,3,3,4,4,5,5,6-undecakis(fluoranyl)-6-[1,2,2,3,3,4,4,5,5,6,6-undecakis(fluoranyl)cyclohexyl]cyclohexane
MOLECULAR FORMULA: C12F22
MOLECULAR WEIGHT: 562.09327
SMILES: C1(C(C(C(C(C1(F)F)(F)F)(F)F)(F)F)(F)F)(C2(C(C(C(C(C2(F)F)(F)F)(F)F)(F)F)(F)F)F)F
Structure:
CAS RN: 558-21-4
CAS Name: trideuterio(fluoro)methane
OPENEYE Name: trideuterio(fluoro)methane
IUPAC Name: trideuterio(fluoro)methane
SYSTEMATIC NAME: trideuterio(fluoranyl)methane
MOLECULAR FORMULA: CH3F
MOLECULAR WEIGHT: 37.051409
SMILES: [2H]C([2H])([2H])F
Structure:
CAS RN: 556-96-7
CAS Name: 1-bromo-3,5-dimethylbenzene
OPENEYE Name: 1-bromo-3,5-dimethyl-benzene
IUPAC Name: 1-bromo-3,5-dimethylbenzene
SYSTEMATIC NAME: 1-bromanyl-3,5-dimethyl-benzene
MOLECULAR FORMULA: C8H9Br
MOLECULAR WEIGHT: 185.06106
SMILES: CC1=CC(=CC(=C1)Br)C
Structure:
CAS RN: 554-21-2
CAS Name: 2,5-bis(trichloromethyl)-1,3-dioxolan-4-one
OPENEYE Name: 2,5-bis(trichloromethyl)-1,3-dioxolan-4-one
IUPAC Name: 2,5-bis(trichloromethyl)-1,3-dioxolan-4-one
SYSTEMATIC NAME: 2,5-bis(trichloromethyl)-1,3-dioxolan-4-one
MOLECULAR FORMULA: C5H2Cl6O3
MOLECULAR WEIGHT: 322.78558
SMILES: C1(C(=O)OC(O1)C(Cl)(Cl)Cl)C(Cl)(Cl)Cl
Structure:
CAS RN: 554-15-4
CAS Name: 1-methyl-2,5-dihydropyrrole
OPENEYE Name: 1-methyl-2,5-dihydropyrrole
IUPAC Name: 1-methyl-2,5-dihydropyrrole
SYSTEMATIC NAME: 1-methyl-2,5-dihydropyrrole
MOLECULAR FORMULA: C5H9N
MOLECULAR WEIGHT: 83.13166
SMILES: CN1CC=CC1
Structure:
CAS RN: 546-44-1
CAS Name: trimethyl-(methyl-phenyl-trimethylsilyloxysilyl)oxysilane
OPENEYE Name: trimethyl-(methyl-phenyl-trimethylsilyloxy-silyl)oxy-silane
IUPAC Name: trimethyl-(methyl-phenyl-trimethylsilyloxysilyl)oxysilane
SYSTEMATIC NAME: trimethyl-(methyl-phenyl-trimethylsilyloxy-silyl)oxy-silane
MOLECULAR FORMULA: C13H26O2Si3
MOLECULAR WEIGHT: 298.60084
SMILES: C[Si](C)(C)O[Si](C)(C1=CC=CC=C1)O[Si](C)(C)C
Structure:
CAS RN: 543-75-9
CAS Name: 2,3-dihydro-1,4-dioxin
OPENEYE Name: 2,3-dihydro-1,4-dioxine
IUPAC Name: 2,3-dihydro-1,4-dioxine
SYSTEMATIC NAME: 2,3-dihydro-1,4-dioxine
MOLECULAR FORMULA: C4H6O2
MOLECULAR WEIGHT: 86.08924
SMILES: C1COC=CO1
Structure:
CAS RN: 539-87-7
CAS Name: 2-oxocanone
OPENEYE Name: oxocan-2-one
IUPAC Name: oxocan-2-one
SYSTEMATIC NAME: oxocan-2-one
MOLECULAR FORMULA: C7H12O2
MOLECULAR WEIGHT: 128.16898
SMILES: C1CCCOC(=O)CC1
Structure:
CAS RN: 539-79-7
CAS Name: 7-methylenecyclohepta-1,3,5-triene
OPENEYE Name: 7-methylenecyclohepta-1,3,5-triene
IUPAC Name: 7-methylidenecyclohepta-1,3,5-triene
SYSTEMATIC NAME: 7-methylidenecyclohepta-1,3,5-triene
MOLECULAR FORMULA: C8H8
MOLECULAR WEIGHT: 104.14912
SMILES: C=C1C=CC=CC=C1
Structure:
CAS RN: 535-52-4
CAS Name: 2-fluoro-5-(trifluoromethyl)aniline
OPENEYE Name: 2-fluoro-5-(trifluoromethyl)aniline
IUPAC Name: 2-fluoro-5-(trifluoromethyl)aniline
SYSTEMATIC NAME: 2-fluoranyl-5-(trifluoromethyl)aniline
MOLECULAR FORMULA: C7H5F4N
MOLECULAR WEIGHT: 179.114913
SMILES: C1=CC(=C(C=C1C(F)(F)F)N)F
Structure:
CAS RN: 529-85-1
CAS Name: 9-fluoroanthracene
OPENEYE Name: 9-fluoroanthracene
IUPAC Name: 9-fluoroanthracene
SYSTEMATIC NAME: 9-fluoranylanthracene
MOLECULAR FORMULA: C14H9F
MOLECULAR WEIGHT: 196.219663
SMILES: C1=CC=C2C(=C1)C=C3C=CC=CC3=C2F
Structure:
CAS RN: 527-18-4
CAS Name: 2,3,5,6-tetramethylbenzene-1,4-diol
OPENEYE Name: 2,3,5,6-tetramethylbenzene-1,4-diol
IUPAC Name: 2,3,5,6-tetramethylbenzene-1,4-diol
SYSTEMATIC NAME: 2,3,5,6-tetramethylbenzene-1,4-diol
MOLECULAR FORMULA: C10H14O2
MOLECULAR WEIGHT: 166.21696
SMILES: CC1=C(C(=C(C(=C1O)C)C)O)C
Structure:
CAS RN: 526-87-4
CAS Name: cyclohex-5-ene-1,2,3,4-tetrol
OPENEYE Name: cyclohex-5-ene-1,2,3,4-tetrol
IUPAC Name: cyclohex-5-ene-1,2,3,4-tetrol
SYSTEMATIC NAME: cyclohex-5-ene-1,2,3,4-tetrol
MOLECULAR FORMULA: C6H10O4
MOLECULAR WEIGHT: 146.1412
SMILES: C1=CC(C(C(C1O)O)O)O
Structure:
CAS RN: 522-33-8
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C15H27N3
MOLECULAR WEIGHT: 249.39498
SMILES: C1CCN2C3CCCCN3C4CCCCN4C2C1
Structure:
CAS RN: 519-61-9
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C12H9N
MOLECULAR WEIGHT: 167.20656
SMILES: C1=CC2=CC=CC3=CC=CC(=C1)N23
Structure:
CAS RN: 518-03-6
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C16H12
MOLECULAR WEIGHT: 204.26648
SMILES: C1CC2=CC=C3C=CC=CC4=C3C2=C1C=C4
Structure:
CAS RN: 518-02-5
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C16H16
MOLECULAR WEIGHT: 208.29824
SMILES: C1CCC2=CC=C3CCC4=C3C2=C(C1)C=C4
Structure:
CAS RN: 512-60-7
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C10H14O2
MOLECULAR WEIGHT: 166.21696
SMILES: CC1(C2CC3C1(C3C2)C(=O)O)C
Structure:
CAS RN: 507-68-6
CAS Name: 2,2,3,3,4,4-hexafluoropentanediamide
OPENEYE Name: 2,2,3,3,4,4-hexafluoropentanediamide
IUPAC Name: 2,2,3,3,4,4-hexafluoropentanediamide
SYSTEMATIC NAME: 2,2,3,3,4,4-hexakis(fluoranyl)pentanediamide
MOLECULAR FORMULA: C5H4F6N2O2
MOLECULAR WEIGHT: 238.087879
SMILES: C(=O)(C(C(C(C(=O)N)(F)F)(F)F)(F)F)N
Structure:
CAS RN: 507-15-3
CAS Name: fluoro(dimethyl)phosphine
OPENEYE Name: fluoro(dimethyl)phosphane
IUPAC Name: fluoro(dimethyl)phosphane
SYSTEMATIC NAME: fluoranyl(dimethyl)phosphane
MOLECULAR FORMULA: C2H6FP
MOLECULAR WEIGHT: 80.041204
SMILES: CP(C)F
Structure:
CAS RN: 506-63-8
CAS Name: beryllium carbanide
OPENEYE Name: beryllium carbanide
IUPAC Name: beryllium carbanide
SYSTEMATIC NAME: beryllium carbanide
MOLECULAR FORMULA: C2H6Be
MOLECULAR WEIGHT: 39.081222
SMILES: [Be+2].[CH3-].[CH3-]
Structure:
CAS RN: 505-63-5
CAS Name: dioxepane
OPENEYE Name: dioxepane
IUPAC Name: dioxepane
SYSTEMATIC NAME: 1,2-dioxepane
MOLECULAR FORMULA: C5H10O2
MOLECULAR WEIGHT: 102.1317
SMILES: C1CCOOCC1
Structure:
CAS RN: 505-20-4
CAS Name: dithiane
OPENEYE Name: dithiane
IUPAC Name: dithiane
SYSTEMATIC NAME: 1,2-dithiane
MOLECULAR FORMULA: C4H8S2
MOLECULAR WEIGHT: 120.23632
SMILES: C1CCSSC1
Structure:
CAS RN: 51330-42-8
CAS Name: dithiane
OPENEYE Name: dithiane
IUPAC Name: dithiane
SYSTEMATIC NAME: 1,2-dithiane
MOLECULAR FORMULA: C4H8S2
MOLECULAR WEIGHT: 120.23632
SMILES: C1CCSSC1
Structure:
CAS RN: 505-19-1
CAS Name: diazinane
OPENEYE Name: hexahydropyridazine
IUPAC Name: diazinane
SYSTEMATIC NAME: 1,2-diazinane
MOLECULAR FORMULA: C4H10N2
MOLECULAR WEIGHT: 86.1356
SMILES: C1CCNNC1
Structure:
CAS RN: 504-72-3
CAS Name: isoxazolidine
OPENEYE Name: isoxazolidine
IUPAC Name: 1,2-oxazolidine
SYSTEMATIC NAME: 1,2-oxazolidine
MOLECULAR FORMULA: C3H7NO
MOLECULAR WEIGHT: 73.09378
SMILES: C1CNOC1
Structure:
CAS RN: 504-64-3
CAS Name: propa-1,2-diene-1,3-dione
OPENEYE Name: propa-1,2-diene-1,3-dione
IUPAC Name: propa-1,2-diene-1,3-dione
SYSTEMATIC NAME: propa-1,2-diene-1,3-dione
MOLECULAR FORMULA: C3O2
MOLECULAR WEIGHT: 68.0309
SMILES: C(=C=O)=C=O
Structure:
CAS RN: 504-44-9
CAS Name: 2,6,11,15-tetramethylhexadecane
OPENEYE Name: 2,6,11,15-tetramethylhexadecane
IUPAC Name: 2,6,11,15-tetramethylhexadecane
SYSTEMATIC NAME: 2,6,11,15-tetramethylhexadecane
MOLECULAR FORMULA: C20H42
MOLECULAR WEIGHT: 282.54748
SMILES: CC(C)CCCC(C)CCCCC(C)CCCC(C)C
Structure:
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