AB21978
231291-22-8 | 6-(Trifluoromethyl)nicotinic acid
Manufacturer: A2B Chem
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CatalogNumber
AB21978
ChemicalName
6-(Trifluoromethyl)nicotinic acid
CasNumber
231291-22-8
MolecularFormula
C7H4F3NO2
MolecularWeight
191.1074
MdlNumber
MFCD00792430
Smiles
OC(=O)c1ccc(nc1)C(F)(F)F
NscNumber
727682
Complexity
204
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
6
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
1.3
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CatalogNumber: AB21978
ChemicalName: 6-(Trifluoromethyl)nicotinic acid
CasNumber: 231291-22-8
MolecularFormula: C7H4F3NO2
MolecularWeight: 191.1074
MdlNumber: MFCD00792430
Smiles: OC(=O)c1ccc(nc1)C(F)(F)F
NscNumber: 727682
Complexity: 204
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 1.3
CatalogNumber:
AB21978
ChemicalName:
6-(Trifluoromethyl)nicotinic acid
CasNumber:
231291-22-8
MolecularFormula:
C7H4F3NO2
MolecularWeight:
191.1074
MdlNumber:
MFCD00792430
Smiles:
OC(=O)c1ccc(nc1)C(F)(F)F
NscNumber:
727682
Complexity:
204
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
1.3
CatalogNumber: __
ChemicalName: __
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MolecularFormula: __
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Smiles: BrC(=C)C(C(F)(F)F)(OC(F)(F)F)F
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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Smiles:
BrC(=C)C(C(F)(F)F)(OC(F)(F)F)F
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Complexity:
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HeavyAtomCount:
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RotatableBondCount:
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MolecularFormula: __
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Smiles: NCc1cc(F)ccc1C(F)(F)F
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Complexity: __
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MolecularFormula:
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MolecularWeight:
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Smiles:
NCc1cc(F)ccc1C(F)(F)F
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Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
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MolecularFormula: __
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Smiles: Brc1nc(cc(c1)[N+](=O)[O-])C(=O)O
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
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Xlogp3: __
CatalogNumber:
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ChemicalName:
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CasNumber:
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MolecularFormula:
__
MolecularWeight:
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MdlNumber:
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Smiles:
Brc1nc(cc(c1)[N+](=O)[O-])C(=O)O
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
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Xlogp3:
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