AF73696
35333-26-7 | 5-(4-Bromophenyl)-5-oxopentanoic acid
Manufacturer: A2B Chem
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CatalogNumber
AF73696
ChemicalName
5-(4-Bromophenyl)-5-oxopentanoic acid
CasNumber
35333-26-7
MolecularFormula
C11H11BrO3
MolecularWeight
271.1072
MdlNumber
MFCD00672057
Smiles
O=C(c1ccc(cc1)Br)CCCC(=O)O
Complexity
232
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
5
Xlogp3
2.4
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CatalogNumber: AF73696
ChemicalName: 5-(4-Bromophenyl)-5-oxopentanoic acid
CasNumber: 35333-26-7
MolecularFormula: C11H11BrO3
MolecularWeight: 271.1072
MdlNumber: MFCD00672057
Smiles: O=C(c1ccc(cc1)Br)CCCC(=O)O
Complexity: 232
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 5
Xlogp3: 2.4
CatalogNumber:
AF73696
ChemicalName:
5-(4-Bromophenyl)-5-oxopentanoic acid
CasNumber:
35333-26-7
MolecularFormula:
C11H11BrO3
MolecularWeight:
271.1072
MdlNumber:
MFCD00672057
Smiles:
O=C(c1ccc(cc1)Br)CCCC(=O)O
Complexity:
232
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
5
Xlogp3:
2.4
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Smiles: O=C(c1ccc(cc1)C(F)(F)F)CCCCCCC(=O)O
Complexity: __
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HeavyAtomCount: __
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HydrogenBondDonorCount: __
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Smiles:
O=C(c1ccc(cc1)C(F)(F)F)CCCCCCC(=O)O
Complexity:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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Smiles: O=C(c1ccc(cc1)Cl)CCCCCC(=O)O
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
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Smiles:
O=C(c1ccc(cc1)Cl)CCCCCC(=O)O
Complexity:
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Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Smiles: OC(=O)CCCCCCC(=O)c1ccc(cc1)Br
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
OC(=O)CCCCCCC(=O)c1ccc(cc1)Br
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
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Xlogp3:
__