AE62172
1258627-10-9 | 2-(2,4-Difluorophenyl)isonicotinic acid
Manufacturer: A2B Chem
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CatalogNumber
AE62172
ChemicalName
2-(2,4-Difluorophenyl)isonicotinic acid
CasNumber
1258627-10-9
MolecularFormula
C12H7F2NO2
MolecularWeight
235.1863
MdlNumber
MFCD17079067
Smiles
Fc1ccc(c(c1)F)c1nccc(c1)C(=O)O
Complexity
288
Covalently-bondedUnitCount
1
HeavyAtomCount
17
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
2.2
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CatalogNumber: AE62172
ChemicalName: 2-(2,4-Difluorophenyl)isonicotinic acid
CasNumber: 1258627-10-9
MolecularFormula: C12H7F2NO2
MolecularWeight: 235.1863
MdlNumber: MFCD17079067
Smiles: Fc1ccc(c(c1)F)c1nccc(c1)C(=O)O
Complexity: 288
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 2.2
CatalogNumber:
AE62172
ChemicalName:
2-(2,4-Difluorophenyl)isonicotinic acid
CasNumber:
1258627-10-9
MolecularFormula:
C12H7F2NO2
MolecularWeight:
235.1863
MdlNumber:
MFCD17079067
Smiles:
Fc1ccc(c(c1)F)c1nccc(c1)C(=O)O
Complexity:
288
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
2.2
CatalogNumber: AE62173
ChemicalName: 6-(3,5-Difluorophenyl)picolinic acid
CasNumber: 1226098-50-5
MolecularFormula: C12H7F2NO2
MolecularWeight: 235.1863
MdlNumber: MFCD11847143
Smiles: Fc1cc(F)cc(c1)c1cccc(n1)C(=O)O
Complexity: 278
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 2.6
CatalogNumber:
AE62173
ChemicalName:
6-(3,5-Difluorophenyl)picolinic acid
CasNumber:
1226098-50-5
MolecularFormula:
C12H7F2NO2
MolecularWeight:
235.1863
MdlNumber:
MFCD11847143
Smiles:
Fc1cc(F)cc(c1)c1cccc(n1)C(=O)O
Complexity:
278
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
2.6
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Fc1ccc(c(c1)F)c1ccnc(c1)C(=O)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Fc1ccc(c(c1)F)c1ccnc(c1)C(=O)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AE62175
ChemicalName: 4,4,7-Trimethyl-1,3-dihydroquinolin-2-one
CasNumber: 133999-05-0
MolecularFormula: C12H15NO
MolecularWeight: 189.2536
MdlNumber: MFCD26131173
Smiles: O=C1Nc2cc(C)ccc2C(C1)(C)C
Complexity: 247
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 1
HydrogenBondDonorCount: 1
RotatableBondCount: __
Xlogp3: 2.3
CatalogNumber:
AE62175
ChemicalName:
4,4,7-Trimethyl-1,3-dihydroquinolin-2-one
CasNumber:
133999-05-0
MolecularFormula:
C12H15NO
MolecularWeight:
189.2536
MdlNumber:
MFCD26131173
Smiles:
O=C1Nc2cc(C)ccc2C(C1)(C)C
Complexity:
247
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
1
HydrogenBondDonorCount:
1
RotatableBondCount:
__
Xlogp3:
2.3