AA86489
1644-71-9 | 5-Bromo-4-fluoro-2-hydroxybenzoic acid
Manufacturer: A2B Chem
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CatalogNumber
AA86489
ChemicalName
5-Bromo-4-fluoro-2-hydroxybenzoic acid
CasNumber
1644-71-9
MolecularFormula
C7H4BrFO3
MolecularWeight
235.0073
MdlNumber
MFCD08235149
Smiles
OC(=O)c1cc(Br)c(cc1O)F
Complexity
188
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
2
RotatableBondCount
1
Xlogp3
2.4
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CatalogNumber: AA86489
ChemicalName: 5-Bromo-4-fluoro-2-hydroxybenzoic acid
CasNumber: 1644-71-9
MolecularFormula: C7H4BrFO3
MolecularWeight: 235.0073
MdlNumber: MFCD08235149
Smiles: OC(=O)c1cc(Br)c(cc1O)F
Complexity: 188
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 1
Xlogp3: 2.4
CatalogNumber:
AA86489
ChemicalName:
5-Bromo-4-fluoro-2-hydroxybenzoic acid
CasNumber:
1644-71-9
MolecularFormula:
C7H4BrFO3
MolecularWeight:
235.0073
MdlNumber:
MFCD08235149
Smiles:
OC(=O)c1cc(Br)c(cc1O)F
Complexity:
188
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
1
Xlogp3:
2.4
CatalogNumber: __
ChemicalName: __
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MolecularFormula: __
MolecularWeight: __
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Smiles: COC(=O)c1ccc(cc1)c1nccc(c1)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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__
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Smiles:
COC(=O)c1ccc(cc1)c1nccc(c1)C
Complexity:
__
Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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RotatableBondCount:
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Xlogp3:
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ChemicalName: __
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Smiles: Cn1ccc2c1nccc2B1OC(C(O1)(C)C)(C)C
Complexity: __
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MolecularFormula:
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Smiles:
Cn1ccc2c1nccc2B1OC(C(O1)(C)C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
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Smiles: Brc1ccc2c(c1)cc(o2)c1ccc2c(c1)cccc2
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Brc1ccc2c(c1)cc(o2)c1ccc2c(c1)cccc2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__