AB35893
289038-22-8 | 5-Bromo-4-chloro-2-fluorobenzoic acid
Manufacturer: A2B Chem
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CatalogNumber
AB35893
ChemicalName
5-Bromo-4-chloro-2-fluorobenzoic acid
CasNumber
289038-22-8
MolecularFormula
C7H3BrClFO2
MolecularWeight
253.4529
MdlNumber
MFCD00672928
Smiles
OC(=O)c1cc(Br)c(cc1F)Cl
Complexity
190
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
2.9
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CatalogNumber: AB35893
ChemicalName: 5-Bromo-4-chloro-2-fluorobenzoic acid
CasNumber: 289038-22-8
MolecularFormula: C7H3BrClFO2
MolecularWeight: 253.4529
MdlNumber: MFCD00672928
Smiles: OC(=O)c1cc(Br)c(cc1F)Cl
Complexity: 190
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 2.9
CatalogNumber:
AB35893
ChemicalName:
5-Bromo-4-chloro-2-fluorobenzoic acid
CasNumber:
289038-22-8
MolecularFormula:
C7H3BrClFO2
MolecularWeight:
253.4529
MdlNumber:
MFCD00672928
Smiles:
OC(=O)c1cc(Br)c(cc1F)Cl
Complexity:
190
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
2.9
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Cc1cc(C)c(c(c1)F)Br
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Cc1cc(C)c(c(c1)F)Br
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AB35895
ChemicalName: 2-Bromo-4-fluorocinnamic acid
CasNumber: 289038-17-1
MolecularFormula: C9H6BrFO2
MolecularWeight: 245.0451
MdlNumber: MFCD00672926
Smiles: OC(=O)C=Cc1ccc(cc1Br)F
Complexity: 218
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 2.7
CatalogNumber:
AB35895
ChemicalName:
2-Bromo-4-fluorocinnamic acid
CasNumber:
289038-17-1
MolecularFormula:
C9H6BrFO2
MolecularWeight:
245.0451
MdlNumber:
MFCD00672926
Smiles:
OC(=O)C=Cc1ccc(cc1Br)F
Complexity:
218
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
2.7
CatalogNumber: AB35896
ChemicalName: 2-Bromo-4-fluorobenzylamine, HCl
CasNumber: 289038-14-8
MolecularFormula: C7H8BrClFN
MolecularWeight: 240.5005
MdlNumber: MFCD00672922
Smiles: NCc1ccc(cc1Br)F.Cl
Complexity: 110
Covalently-bondedUnitCount: 2
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 2
RotatableBondCount: 1
Xlogp3: __
CatalogNumber:
AB35896
ChemicalName:
2-Bromo-4-fluorobenzylamine, HCl
CasNumber:
289038-14-8
MolecularFormula:
C7H8BrClFN
MolecularWeight:
240.5005
MdlNumber:
MFCD00672922
Smiles:
NCc1ccc(cc1Br)F.Cl
Complexity:
110
Covalently-bondedUnitCount:
2
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
2
RotatableBondCount:
1
Xlogp3:
__