AA10354
1026962-68-4 | 6-Bromo-2-fluoro-3-(trifluoromethyl)benzoic acid
Manufacturer: A2B Chem
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CatalogNumber
AA10354
ChemicalName
6-Bromo-2-fluoro-3-(trifluoromethyl)benzoic acid
CasNumber
1026962-68-4
MolecularFormula
C8H3BrF4O2
MolecularWeight
287.0058
MdlNumber
MFCD21365092
Smiles
OC(=O)c1c(Br)ccc(c1F)C(F)(F)F
Complexity
256
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
6
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
3.1
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CatalogNumber: AA10354
ChemicalName: 6-Bromo-2-fluoro-3-(trifluoromethyl)benzoic acid
CasNumber: 1026962-68-4
MolecularFormula: C8H3BrF4O2
MolecularWeight: 287.0058
MdlNumber: MFCD21365092
Smiles: OC(=O)c1c(Br)ccc(c1F)C(F)(F)F
Complexity: 256
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 3.1
CatalogNumber:
AA10354
ChemicalName:
6-Bromo-2-fluoro-3-(trifluoromethyl)benzoic acid
CasNumber:
1026962-68-4
MolecularFormula:
C8H3BrF4O2
MolecularWeight:
287.0058
MdlNumber:
MFCD21365092
Smiles:
OC(=O)c1c(Br)ccc(c1F)C(F)(F)F
Complexity:
256
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
3.1
CatalogNumber: __
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MolecularFormula: __
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Smiles: CC(=CCO)CCC#CC
Complexity: __
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HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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Smiles:
CC(=CCO)CCC#CC
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RotatableBondCount:
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Smiles: CCOc1ccc(cc1)C(=O)OC1CCN(CC1)C
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CCOc1ccc(cc1)C(=O)OC1CCN(CC1)C
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Smiles: CO[C@@H]1C=CC=C[C@H]1OC
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HydrogenBondDonorCount: __
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Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
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MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
CO[C@@H]1C=CC=C[C@H]1OC
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
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