AB63759
13494-06-9 | 3,4-Dimethylcyclopentane-1,2-dione
Manufacturer: A2B Chem
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CatalogNumber
AB63759
ChemicalName
3,4-Dimethylcyclopentane-1,2-dione
CasNumber
13494-06-9
MolecularFormula
C7H10O2
MolecularWeight
126.1531
MdlNumber
MFCD00143063
Smiles
CC1CC(=O)C(=O)C1C
Complexity
160
Covalently-bondedUnitCount
1
HeavyAtomCount
9
HydrogenBondAcceptorCount
2
UndefinedAtomStereocenterCount
2
Xlogp3
0.6
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CatalogNumber: AB63759
ChemicalName: 3,4-Dimethylcyclopentane-1,2-dione
CasNumber: 13494-06-9
MolecularFormula: C7H10O2
MolecularWeight: 126.1531
MdlNumber: MFCD00143063
Smiles: CC1CC(=O)C(=O)C1C
Complexity: 160
Covalently-bondedUnitCount: 1
HeavyAtomCount: 9
HydrogenBondAcceptorCount: 2
UndefinedAtomStereocenterCount: 2
Xlogp3: 0.6
CatalogNumber:
AB63759
ChemicalName:
3,4-Dimethylcyclopentane-1,2-dione
CasNumber:
13494-06-9
MolecularFormula:
C7H10O2
MolecularWeight:
126.1531
MdlNumber:
MFCD00143063
Smiles:
CC1CC(=O)C(=O)C1C
Complexity:
160
Covalently-bondedUnitCount:
1
HeavyAtomCount:
9
HydrogenBondAcceptorCount:
2
UndefinedAtomStereocenterCount:
2
Xlogp3:
0.6
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCC(C(CC)(O)C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCC(C(CC)(O)C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CC(=O)Nc1ccc(c(c1)C)C
Complexity: 167
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: 2.1
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CC(=O)Nc1ccc(c(c1)C)C
Complexity:
167
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
2.1
CatalogNumber: AB63763
ChemicalName: 3,4-Dimethylbenzaldehyde
CasNumber: 5973-71-7
MolecularFormula: C9H10O
MolecularWeight: 134.1751
MdlNumber: MFCD00016612
Smiles: O=Cc1ccc(c(c1)C)C
Complexity: 120
Covalently-bondedUnitCount: 1
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 1
UndefinedAtomStereocenterCount: __
Xlogp3: 2.7
CatalogNumber:
AB63763
ChemicalName:
3,4-Dimethylbenzaldehyde
CasNumber:
5973-71-7
MolecularFormula:
C9H10O
MolecularWeight:
134.1751
MdlNumber:
MFCD00016612
Smiles:
O=Cc1ccc(c(c1)C)C
Complexity:
120
Covalently-bondedUnitCount:
1
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
1
UndefinedAtomStereocenterCount:
__
Xlogp3:
2.7