AC10043
87789-84-2 | 5-(3-Trifluoromethylphenyl)picolinic acid
Manufacturer: A2B Chem
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CatalogNumber
AC10043
ChemicalName
5-(3-Trifluoromethylphenyl)picolinic acid
CasNumber
87789-84-2
MolecularFormula
C13H8F3NO2
MolecularWeight
267.2033
MdlNumber
MFCD12406460
Smiles
OC(=O)c1ccc(cn1)c1cccc(c1)C(F)(F)F
Complexity
332
Covalently-bondedUnitCount
1
HeavyAtomCount
19
HydrogenBondAcceptorCount
6
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
3.2
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CatalogNumber: AC10043
ChemicalName: 5-(3-Trifluoromethylphenyl)picolinic acid
CasNumber: 87789-84-2
MolecularFormula: C13H8F3NO2
MolecularWeight: 267.2033
MdlNumber: MFCD12406460
Smiles: OC(=O)c1ccc(cn1)c1cccc(c1)C(F)(F)F
Complexity: 332
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 3.2
CatalogNumber:
AC10043
ChemicalName:
5-(3-Trifluoromethylphenyl)picolinic acid
CasNumber:
87789-84-2
MolecularFormula:
C13H8F3NO2
MolecularWeight:
267.2033
MdlNumber:
MFCD12406460
Smiles:
OC(=O)c1ccc(cn1)c1cccc(c1)C(F)(F)F
Complexity:
332
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
3.2
CatalogNumber: __
ChemicalName: __
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MolecularFormula: __
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Smiles: COc1cc(ccc1OC)c1ccc(nc1)C(=O)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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Smiles:
COc1cc(ccc1OC)c1ccc(nc1)C(=O)O
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Smiles: Fc1cnc(nc1)N1CCNCC1
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Smiles:
Fc1cnc(nc1)N1CCNCC1
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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Smiles: O=Cc1ccc2c(c1)OC=CO2
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HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
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Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=Cc1ccc2c(c1)OC=CO2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__