CAS RN: 2809-78-1
CAS Name: 1-ethynyl-1-cycloheptanol
OPENEYE Name: 1-ethynylcycloheptanol
IUPAC Name: 1-ethynylcycloheptan-1-ol
SYSTEMATIC NAME: 1-ethynylcycloheptan-1-ol
MOLECULAR FORMULA: C9H14O
MOLECULAR WEIGHT: 138.20686
SMILES: C#CC1(CCCCCC1)O
Structure:
CAS RN: 2809-69-0
CAS Name: hexa-2,4-diyne
OPENEYE Name: hexa-2,4-diyne
IUPAC Name: hexa-2,4-diyne
SYSTEMATIC NAME: hexa-2,4-diyne
MOLECULAR FORMULA: C6H6
MOLECULAR WEIGHT: 78.11184
SMILES: CC#CC#CC
Structure:
CAS RN: 2808-76-6
CAS Name: 1,3-dimethylcyclohexene
OPENEYE Name: 1,3-dimethylcyclohexene
IUPAC Name: 1,3-dimethylcyclohexene
SYSTEMATIC NAME: 1,3-dimethylcyclohexene
MOLECULAR FORMULA: C8H14
MOLECULAR WEIGHT: 110.19676
SMILES: CC1CCCC(=C1)C
Structure:
CAS RN: 2808-75-5
CAS Name: 1-methyl-2-methylenecyclohexane
OPENEYE Name: 1-methyl-2-methylene-cyclohexane
IUPAC Name: 1-methyl-2-methylidenecyclohexane
SYSTEMATIC NAME: 1-methyl-2-methylidene-cyclohexane
MOLECULAR FORMULA: C8H14
MOLECULAR WEIGHT: 110.19676
SMILES: CC1CCCCC1=C
Structure:
CAS RN: 2808-71-1
CAS Name: 3-ethylcyclohexene
OPENEYE Name: 3-ethylcyclohexene
IUPAC Name: 3-ethylcyclohexene
SYSTEMATIC NAME: 3-ethylcyclohexene
MOLECULAR FORMULA: C8H14
MOLECULAR WEIGHT: 110.19676
SMILES: CCC1CCCC=C1
Structure:
CAS RN: 2808-38-0
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C12H16
MOLECULAR WEIGHT: 160.25544
SMILES: C1CC2C3CCC(C2C=C1)C=C3
Structure:
CAS RN: 2806-97-5
CAS Name: 1,1-diethoxy-2-butyne
OPENEYE Name: 1,1-diethoxybut-2-yne
IUPAC Name: 1,1-diethoxybut-2-yne
SYSTEMATIC NAME: 1,1-diethoxybut-2-yne
MOLECULAR FORMULA: C8H14O2
MOLECULAR WEIGHT: 142.19556
SMILES: CCOC(C#CC)OCC
Structure:
CAS RN: 2806-84-0
CAS Name: 3-methoxypropanal
OPENEYE Name: 3-methoxypropanal
IUPAC Name: 3-methoxypropanal
SYSTEMATIC NAME: 3-methoxypropanal
MOLECULAR FORMULA: C4H8O2
MOLECULAR WEIGHT: 88.10512
SMILES: COCCC=O
Structure:
CAS RN: 2805-22-3
CAS Name: 3-fluoro-1-propyne
OPENEYE Name: 3-fluoroprop-1-yne
IUPAC Name: 3-fluoroprop-1-yne
SYSTEMATIC NAME: 3-fluoranylprop-1-yne
MOLECULAR FORMULA: C3H3F
MOLECULAR WEIGHT: 58.054323
SMILES: C#CCF
Structure:
CAS RN: 2802-62-2
CAS Name: 4,6-difluoropyrimidine
OPENEYE Name: 4,6-difluoropyrimidine
IUPAC Name: 4,6-difluoropyrimidine
SYSTEMATIC NAME: 4,6-bis(fluoranyl)pyrimidine
MOLECULAR FORMULA: C4H2F2N2
MOLECULAR WEIGHT: 116.068886
SMILES: C1=C(N=CN=C1F)F
Structure:
CAS RN: 2802-61-1
CAS Name: 2,4-difluoropyrimidine
OPENEYE Name: 2,4-difluoropyrimidine
IUPAC Name: 2,4-difluoropyrimidine
SYSTEMATIC NAME: 2,4-bis(fluoranyl)pyrimidine
MOLECULAR FORMULA: C4H2F2N2
MOLECULAR WEIGHT: 116.068886
SMILES: C1=CN=C(N=C1F)F
Structure:
CAS RN: 2800-87-5
CAS Name: 3,3,6,6-tetramethylthiepane-4,5-dione
OPENEYE Name: 3,3,6,6-tetramethylthiepane-4,5-dione
IUPAC Name: 3,3,6,6-tetramethylthiepane-4,5-dione
SYSTEMATIC NAME: 3,3,6,6-tetramethylthiepane-4,5-dione
MOLECULAR FORMULA: C10H16O2S
MOLECULAR WEIGHT: 200.29784
SMILES: CC1(CSCC(C(=O)C1=O)(C)C)C
Structure:
CAS RN: 2799-73-7
CAS Name: 1-bromo-3-isothiocyanatopropane
OPENEYE Name: 1-bromo-3-isothiocyanato-propane
IUPAC Name: 1-bromo-3-isothiocyanatopropane
SYSTEMATIC NAME: 1-bromanyl-3-isothiocyanato-propane
MOLECULAR FORMULA: C4H6BrNS
MOLECULAR WEIGHT: 180.06614
SMILES: C(CN=C=S)CBr
Structure:
CAS RN: 2799-72-6
CAS Name: 1-chloro-3-isothiocyanatopropane
OPENEYE Name: 1-chloro-3-isothiocyanato-propane
IUPAC Name: 1-chloro-3-isothiocyanatopropane
SYSTEMATIC NAME: 1-chloranyl-3-isothiocyanato-propane
MOLECULAR FORMULA: C4H6ClNS
MOLECULAR WEIGHT: 135.61514
SMILES: C(CN=C=S)CCl
Structure:
CAS RN: 2799-44-2
CAS Name: 1,2,3-tri(propan-2-ylidene)cyclopropane
OPENEYE Name: 1,2,3-triisopropylidenecyclopropane
IUPAC Name: 1,2,3-tri(propan-2-ylidene)cyclopropane
SYSTEMATIC NAME: 1,2,3-tri(propan-2-ylidene)cyclopropane
MOLECULAR FORMULA: C12H18
MOLECULAR WEIGHT: 162.27132
SMILES: CC(=C1C(=C(C)C)C1=C(C)C)C
Structure:
CAS RN: 2783-98-4
CAS Name: 5-(2H-tetrazol-5-yl)-2H-tetrazole
OPENEYE Name: 5-(2H-tetrazol-5-yl)-2H-tetrazole
IUPAC Name: 5-(2H-tetrazol-5-yl)-2H-tetrazole
SYSTEMATIC NAME: 5-(2H-1,2,3,4-tetrazol-5-yl)-2H-1,2,3,4-tetrazole
MOLECULAR FORMULA: C2H2N8
MOLECULAR WEIGHT: 138.09088
SMILES: C1(=NNN=N1)C2=NNN=N2
Structure:
CAS RN: 2773-58-2
CAS Name: 1-methoxy-3-methylenecyclohexene
OPENEYE Name: 1-methoxy-3-methylene-cyclohexene
IUPAC Name: 1-methoxy-3-methylidenecyclohexene
SYSTEMATIC NAME: 1-methoxy-3-methylidene-cyclohexene
MOLECULAR FORMULA: C8H12O
MOLECULAR WEIGHT: 124.18028
SMILES: COC1=CC(=C)CCC1
Structure:
CAS RN: 2764-87-6
CAS Name: 2,2-dimethyl-1,3-dihydro-2-benzosilole
OPENEYE Name: 2,2-dimethyl-1,3-dihydro-2-benzosilole
IUPAC Name: 2,2-dimethyl-1,3-dihydro-2-benzosilole
SYSTEMATIC NAME: 2,2-dimethyl-1,3-dihydro-2-benzosilole
MOLECULAR FORMULA: C10H14Si
MOLECULAR WEIGHT: 162.30366
SMILES: C[Si]1(CC2=CC=CC=C2C1)C
Structure:
CAS RN: 2763-77-1
CAS Name: 3,3-dimethyl-2-propan-2-yloxaziridine
OPENEYE Name: 2-isopropyl-3,3-dimethyl-oxaziridine
IUPAC Name: 3,3-dimethyl-2-propan-2-yloxaziridine
SYSTEMATIC NAME: 3,3-dimethyl-2-propan-2-yl-1,2-oxaziridine
MOLECULAR FORMULA: C6H13NO
MOLECULAR WEIGHT: 115.17352
SMILES: CC(C)N1C(O1)(C)C
Structure:
CAS RN: 2763-67-9
CAS Name: N-butylpentanamide
OPENEYE Name: N-butylpentanamide
IUPAC Name: N-butylpentanamide
SYSTEMATIC NAME: N-butylpentanamide
MOLECULAR FORMULA: C9H19NO
MOLECULAR WEIGHT: 157.25326
SMILES: CCCCC(=O)NCCCC
Structure:
CAS RN: 2761-22-0
CAS Name: 1-isocyanato-4-(4-isocyanatophenyl)benzene
OPENEYE Name: 1-isocyanato-4-(4-isocyanatophenyl)benzene
IUPAC Name: 1-isocyanato-4-(4-isocyanatophenyl)benzene
SYSTEMATIC NAME: 1-isocyanato-4-(4-isocyanatophenyl)benzene
MOLECULAR FORMULA: C14H8N2O2
MOLECULAR WEIGHT: 236.22552
SMILES: C1=CC(=CC=C1C2=CC=C(C=C2)N=C=O)N=C=O
Structure:
CAS RN: 2760-32-9
CAS Name: N-(2-chlorophenyl)propanamide
OPENEYE Name: N-(2-chlorophenyl)propanamide
IUPAC Name: N-(2-chlorophenyl)propanamide
SYSTEMATIC NAME: N-(2-chlorophenyl)propanamide
MOLECULAR FORMULA: C9H10ClNO
MOLECULAR WEIGHT: 183.6348
SMILES: CCC(=O)NC1=CC=CC=C1Cl
Structure:
CAS RN: 2750-71-2
CAS Name: 4-ethylhex-3-en-1-yne
OPENEYE Name: 4-ethylhex-3-en-1-yne
IUPAC Name: 4-ethylhex-3-en-1-yne
SYSTEMATIC NAME: 4-ethylhex-3-en-1-yne
MOLECULAR FORMULA: C8H12
MOLECULAR WEIGHT: 108.18088
SMILES: CCC(=CC#C)CC
Structure:
CAS RN: 2749-93-1
CAS Name: 1-methyl-4-prop-1-ynylbenzene
OPENEYE Name: 1-methyl-4-prop-1-ynyl-benzene
IUPAC Name: 1-methyl-4-prop-1-ynylbenzene
SYSTEMATIC NAME: 1-methyl-4-prop-1-ynyl-benzene
MOLECULAR FORMULA: C10H10
MOLECULAR WEIGHT: 130.1864
SMILES: CC#CC1=CC=C(C=C1)C
Structure:
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