AD54106
1355247-36-7 | 2-(2-Carboxyphenyl)-5-fluorobenzoic acid
Manufacturer: A2B Chem
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CatalogNumber
AD54106
ChemicalName
2-(2-Carboxyphenyl)-5-fluorobenzoic acid
CasNumber
1355247-36-7
MolecularFormula
C14H9FO4
MolecularWeight
260.2173
MdlNumber
MFCD21332946
Smiles
Fc1ccc(c(c1)C(=O)O)c1ccccc1C(=O)O
Complexity
357
Covalently-bondedUnitCount
1
HeavyAtomCount
19
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
2
RotatableBondCount
3
Xlogp3
2.2
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CatalogNumber: AD54106
ChemicalName: 2-(2-Carboxyphenyl)-5-fluorobenzoic acid
CasNumber: 1355247-36-7
MolecularFormula: C14H9FO4
MolecularWeight: 260.2173
MdlNumber: MFCD21332946
Smiles: Fc1ccc(c(c1)C(=O)O)c1ccccc1C(=O)O
Complexity: 357
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 2
RotatableBondCount: 3
Xlogp3: 2.2
CatalogNumber:
AD54106
ChemicalName:
2-(2-Carboxyphenyl)-5-fluorobenzoic acid
CasNumber:
1355247-36-7
MolecularFormula:
C14H9FO4
MolecularWeight:
260.2173
MdlNumber:
MFCD21332946
Smiles:
Fc1ccc(c(c1)C(=O)O)c1ccccc1C(=O)O
Complexity:
357
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
2
RotatableBondCount:
3
Xlogp3:
2.2
CatalogNumber: AD54107
ChemicalName: N-Cyclopropyl 2-bromo-6-fluorobenzylamine
CasNumber: 1355247-19-6
MolecularFormula: C10H11BrFN
MolecularWeight: 244.1034
MdlNumber: MFCD21333065
Smiles: Fc1cccc(c1CNC1CC1)Br
Complexity: 172
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 2.6
CatalogNumber:
AD54107
ChemicalName:
N-Cyclopropyl 2-bromo-6-fluorobenzylamine
CasNumber:
1355247-19-6
MolecularFormula:
C10H11BrFN
MolecularWeight:
244.1034
MdlNumber:
MFCD21333065
Smiles:
Fc1cccc(c1CNC1CC1)Br
Complexity:
172
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
2.6
CatalogNumber: AD54108
ChemicalName: N,N-Dimethyl 2-bromo-6-fluorobenzylamine
CasNumber: 1355247-17-4
MolecularFormula: C9H11BrFN
MolecularWeight: 232.0927
MdlNumber: MFCD21333061
Smiles: CN(Cc1c(F)cccc1Br)C
Complexity: 141
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: __
RotatableBondCount: 2
Xlogp3: 2.5
CatalogNumber:
AD54108
ChemicalName:
N,N-Dimethyl 2-bromo-6-fluorobenzylamine
CasNumber:
1355247-17-4
MolecularFormula:
C9H11BrFN
MolecularWeight:
232.0927
MdlNumber:
MFCD21333061
Smiles:
CN(Cc1c(F)cccc1Br)C
Complexity:
141
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
__
RotatableBondCount:
2
Xlogp3:
2.5
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)c1ccc(cc1Cl)c1ccccc1N(=O)=O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)c1ccc(cc1Cl)c1ccccc1N(=O)=O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__