AB61352
64695-84-7 | 2-Bromo-4,5-difluorobenzoic acid
Manufacturer: A2B Chem
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CatalogNumber
AB61352
ChemicalName
2-Bromo-4,5-difluorobenzoic acid
CasNumber
64695-84-7
MolecularFormula
C7H3BrF2O2
MolecularWeight
236.9983
MdlNumber
MFCD04973422
Smiles
OC(=O)c1cc(F)c(cc1Br)F
Complexity
188
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
2.3
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CatalogNumber: AB61352
ChemicalName: 2-Bromo-4,5-difluorobenzoic acid
CasNumber: 64695-84-7
MolecularFormula: C7H3BrF2O2
MolecularWeight: 236.9983
MdlNumber: MFCD04973422
Smiles: OC(=O)c1cc(F)c(cc1Br)F
Complexity: 188
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 2.3
CatalogNumber:
AB61352
ChemicalName:
2-Bromo-4,5-difluorobenzoic acid
CasNumber:
64695-84-7
MolecularFormula:
C7H3BrF2O2
MolecularWeight:
236.9983
MdlNumber:
MFCD04973422
Smiles:
OC(=O)c1cc(F)c(cc1Br)F
Complexity:
188
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
2.3
CatalogNumber: AB61353
ChemicalName: 2-Bromo-4,5-difluorobenzonitrile
CasNumber: 64695-82-5
MolecularFormula: C7H2BrF2N
MolecularWeight: 217.9983
MdlNumber: MFCD00061016
Smiles: N#Cc1cc(F)c(cc1Br)F
Complexity: 188
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 2.5
CatalogNumber:
AB61353
ChemicalName:
2-Bromo-4,5-difluorobenzonitrile
CasNumber:
64695-82-5
MolecularFormula:
C7H2BrF2N
MolecularWeight:
217.9983
MdlNumber:
MFCD00061016
Smiles:
N#Cc1cc(F)c(cc1Br)F
Complexity:
188
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
2.5
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OB(c1cc(F)c(cc1Br)F)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OB(c1cc(F)c(cc1Br)F)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Cc1cc([N+](=O)[O-])c(cc1Br)[N+](=O)[O-]
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Cc1cc([N+](=O)[O-])c(cc1Br)[N+](=O)[O-]
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__