AF32243
27462-91-5 | 5-(3-Methoxyphenyl)cyclohexane-1,3-dione
Manufacturer: A2B Chem
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CatalogNumber
AF32243
ChemicalName
5-(3-Methoxyphenyl)cyclohexane-1,3-dione
CasNumber
27462-91-5
MolecularFormula
C13H14O3
MolecularWeight
218.2485
MdlNumber
MFCD06660538
Smiles
COc1cccc(c1)C1CC(=O)CC(=O)C1
Complexity
269
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
3
RotatableBondCount
2
Xlogp3
1.3
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CatalogNumber: AF32243
ChemicalName: 5-(3-Methoxyphenyl)cyclohexane-1,3-dione
CasNumber: 27462-91-5
MolecularFormula: C13H14O3
MolecularWeight: 218.2485
MdlNumber: MFCD06660538
Smiles: COc1cccc(c1)C1CC(=O)CC(=O)C1
Complexity: 269
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 3
RotatableBondCount: 2
Xlogp3: 1.3
CatalogNumber:
AF32243
ChemicalName:
5-(3-Methoxyphenyl)cyclohexane-1,3-dione
CasNumber:
27462-91-5
MolecularFormula:
C13H14O3
MolecularWeight:
218.2485
MdlNumber:
MFCD06660538
Smiles:
COc1cccc(c1)C1CC(=O)CC(=O)C1
Complexity:
269
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
3
RotatableBondCount:
2
Xlogp3:
1.3
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Smiles: SC1=NC(=O)C(=Cc2c(F)cccc2Cl)S1
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SC1=NC(=O)C(=Cc2c(F)cccc2Cl)S1
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Smiles: O=C(c1ccccc1)CSc1nnnn1c1ccccc1
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Smiles:
O=C(c1ccccc1)CSc1nnnn1c1ccccc1
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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RotatableBondCount:
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Smiles: CC(=O)COc1ccc2c(c1C)oc(=O)c1c2cccc1
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
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__
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CasNumber:
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MolecularFormula:
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MdlNumber:
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Smiles:
CC(=O)COc1ccc2c(c1C)oc(=O)c1c2cccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__