AA36482
1261978-52-2 | 4-(3-Carboxy-5-fluorophenyl)-2-fluorobenzoic acid
Manufacturer: A2B Chem
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CatalogNumber
AA36482
ChemicalName
4-(3-Carboxy-5-fluorophenyl)-2-fluorobenzoic acid
CasNumber
1261978-52-2
MolecularFormula
C14H8F2O4
MolecularWeight
278.2077
MdlNumber
MFCD18321471
Smiles
Fc1cc(cc(c1)c1ccc(c(c1)F)C(=O)O)C(=O)O
Complexity
387
Covalently-bondedUnitCount
1
HeavyAtomCount
20
HydrogenBondAcceptorCount
6
HydrogenBondDonorCount
2
RotatableBondCount
3
Xlogp3
2.8
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CatalogNumber: AA36482
ChemicalName: 4-(3-Carboxy-5-fluorophenyl)-2-fluorobenzoic acid
CasNumber: 1261978-52-2
MolecularFormula: C14H8F2O4
MolecularWeight: 278.2077
MdlNumber: MFCD18321471
Smiles: Fc1cc(cc(c1)c1ccc(c(c1)F)C(=O)O)C(=O)O
Complexity: 387
Covalently-bondedUnitCount: 1
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 2
RotatableBondCount: 3
Xlogp3: 2.8
CatalogNumber:
AA36482
ChemicalName:
4-(3-Carboxy-5-fluorophenyl)-2-fluorobenzoic acid
CasNumber:
1261978-52-2
MolecularFormula:
C14H8F2O4
MolecularWeight:
278.2077
MdlNumber:
MFCD18321471
Smiles:
Fc1cc(cc(c1)c1ccc(c(c1)F)C(=O)O)C(=O)O
Complexity:
387
Covalently-bondedUnitCount:
1
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
2
RotatableBondCount:
3
Xlogp3:
2.8
CatalogNumber: AA36483
ChemicalName: 6-(4-Fluoro-3-methoxyphenyl)picolinic acid
CasNumber: 1261977-99-4
MolecularFormula: C13H10FNO3
MolecularWeight: 247.2218
MdlNumber: MFCD18317543
Smiles: COc1cc(ccc1F)c1cccc(n1)C(=O)O
Complexity: 300
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 2.4
CatalogNumber:
AA36483
ChemicalName:
6-(4-Fluoro-3-methoxyphenyl)picolinic acid
CasNumber:
1261977-99-4
MolecularFormula:
C13H10FNO3
MolecularWeight:
247.2218
MdlNumber:
MFCD18317543
Smiles:
COc1cc(ccc1F)c1cccc(n1)C(=O)O
Complexity:
300
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
2.4
CatalogNumber: AA36484
ChemicalName: 5-(4-Cyanophenyl)-2-fluorobenzoic acid
CasNumber: 1261977-82-5
MolecularFormula: C14H8FNO2
MolecularWeight: 241.2172
MdlNumber: MFCD18319153
Smiles: N#Cc1ccc(cc1)c1ccc(c(c1)C(=O)O)F
Complexity: 354
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 2.9
CatalogNumber:
AA36484
ChemicalName:
5-(4-Cyanophenyl)-2-fluorobenzoic acid
CasNumber:
1261977-82-5
MolecularFormula:
C14H8FNO2
MolecularWeight:
241.2172
MdlNumber:
MFCD18319153
Smiles:
N#Cc1ccc(cc1)c1ccc(c(c1)C(=O)O)F
Complexity:
354
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
2.9
CatalogNumber: AA36485
ChemicalName: 3-(3-Cyanophenyl)-4-fluorobenzoic acid
CasNumber: 1261977-67-6
MolecularFormula: C14H8FNO2
MolecularWeight: 241.2172
MdlNumber: MFCD18319125
Smiles: N#Cc1cccc(c1)c1cc(ccc1F)C(=O)O
Complexity: 362
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 2.9
CatalogNumber:
AA36485
ChemicalName:
3-(3-Cyanophenyl)-4-fluorobenzoic acid
CasNumber:
1261977-67-6
MolecularFormula:
C14H8FNO2
MolecularWeight:
241.2172
MdlNumber:
MFCD18319125
Smiles:
N#Cc1cccc(c1)c1cc(ccc1F)C(=O)O
Complexity:
362
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
2.9