AA45998
131747-42-7 | 2-Trifluoromethyl-6-pyridinecarboxylic acid
Manufacturer: A2B Chem
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CatalogNumber
AA45998
ChemicalName
2-Trifluoromethyl-6-pyridinecarboxylic acid
CasNumber
131747-42-7
MolecularFormula
C7H4F3NO2
MolecularWeight
191.1074
MdlNumber
MFCD02180819
Smiles
OC(=O)c1cccc(n1)C(F)(F)F
Complexity
204
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
6
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
1.6
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CatalogNumber: AA45998
ChemicalName: 2-Trifluoromethyl-6-pyridinecarboxylic acid
CasNumber: 131747-42-7
MolecularFormula: C7H4F3NO2
MolecularWeight: 191.1074
MdlNumber: MFCD02180819
Smiles: OC(=O)c1cccc(n1)C(F)(F)F
Complexity: 204
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 1.6
CatalogNumber:
AA45998
ChemicalName:
2-Trifluoromethyl-6-pyridinecarboxylic acid
CasNumber:
131747-42-7
MolecularFormula:
C7H4F3NO2
MolecularWeight:
191.1074
MdlNumber:
MFCD02180819
Smiles:
OC(=O)c1cccc(n1)C(F)(F)F
Complexity:
204
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
1.6
CatalogNumber: AA45999
ChemicalName: 2-(Trifluoromethyl)isonicotinic acid
CasNumber: 131747-41-6
MolecularFormula: C7H4F3NO2
MolecularWeight: 191.1074
MdlNumber: MFCD07774132
Smiles: OC(=O)c1ccnc(c1)C(F)(F)F
Complexity: 204
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 1.3
CatalogNumber:
AA45999
ChemicalName:
2-(Trifluoromethyl)isonicotinic acid
CasNumber:
131747-41-6
MolecularFormula:
C7H4F3NO2
MolecularWeight:
191.1074
MdlNumber:
MFCD07774132
Smiles:
OC(=O)c1ccnc(c1)C(F)(F)F
Complexity:
204
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
1.3
CatalogNumber: AA46000
ChemicalName: 5-(Trifluoromethyl)nicotinic acid
CasNumber: 131747-40-5
MolecularFormula: C7H4F3NO2
MolecularWeight: 191.1074
MdlNumber: MFCD07774128
Smiles: OC(=O)c1cncc(c1)C(F)(F)F
Complexity: 204
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 1.3
CatalogNumber:
AA46000
ChemicalName:
5-(Trifluoromethyl)nicotinic acid
CasNumber:
131747-40-5
MolecularFormula:
C7H4F3NO2
MolecularWeight:
191.1074
MdlNumber:
MFCD07774128
Smiles:
OC(=O)c1cncc(c1)C(F)(F)F
Complexity:
204
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
1.3
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Smiles: CC(=O)OCc1cccnc1C#N
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Smiles:
CC(=O)OCc1cccnc1C#N
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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