AE08928
1073-13-8 | 4,4-Dimethylcyclohex-2-enone
Manufacturer: A2B Chem
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CatalogNumber
AE08928
ChemicalName
4,4-Dimethylcyclohex-2-enone
CasNumber
1073-13-8
MolecularFormula
C8H12O
MolecularWeight
124.1803
MdlNumber
MFCD00009695
Smiles
O=C1CCC(C=C1)(C)C
Complexity
154
Covalently-bondedUnitCount
1
HeavyAtomCount
9
HydrogenBondAcceptorCount
1
Xlogp3
1.8
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CatalogNumber: AE08928
ChemicalName: 4,4-Dimethylcyclohex-2-enone
CasNumber: 1073-13-8
MolecularFormula: C8H12O
MolecularWeight: 124.1803
MdlNumber: MFCD00009695
Smiles: O=C1CCC(C=C1)(C)C
Complexity: 154
Covalently-bondedUnitCount: 1
HeavyAtomCount: 9
HydrogenBondAcceptorCount: 1
Xlogp3: 1.8
CatalogNumber:
AE08928
ChemicalName:
4,4-Dimethylcyclohex-2-enone
CasNumber:
1073-13-8
MolecularFormula:
C8H12O
MolecularWeight:
124.1803
MdlNumber:
MFCD00009695
Smiles:
O=C1CCC(C=C1)(C)C
Complexity:
154
Covalently-bondedUnitCount:
1
HeavyAtomCount:
9
HydrogenBondAcceptorCount:
1
Xlogp3:
1.8
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: NCc1ccc(c(c1)F)C#N.Cl
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
NCc1ccc(c(c1)F)C#N.Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
Xlogp3:
__
CatalogNumber: AE08930
ChemicalName: 3-Ethynylbenzoic acid
CasNumber: 10601-99-7
MolecularFormula: C9H6O2
MolecularWeight: 146.1427
MdlNumber: MFCD06658448
Smiles: C#Cc1cccc(c1)C(=O)O
Complexity: 199
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 2
Xlogp3: 2.3
CatalogNumber:
AE08930
ChemicalName:
3-Ethynylbenzoic acid
CasNumber:
10601-99-7
MolecularFormula:
C9H6O2
MolecularWeight:
146.1427
MdlNumber:
MFCD06658448
Smiles:
C#Cc1cccc(c1)C(=O)O
Complexity:
199
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
2
Xlogp3:
2.3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCOC(=O)CC(=O)c1cc(F)c(c(c1F)OC)F
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCOC(=O)CC(=O)c1cc(F)c(c(c1F)OC)F
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
Xlogp3:
__