AA86315
16426-64-5 | 2-Bromo-4-nitrobenzoic acid
Manufacturer: A2B Chem
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CatalogNumber
AA86315
ChemicalName
2-Bromo-4-nitrobenzoic acid
CasNumber
16426-64-5
MolecularFormula
C7H4BrNO4
MolecularWeight
246.015
MdlNumber
MFCD00234252
Smiles
OC(=O)c1ccc(cc1Br)[N+](=O)[O-]
NscNumber
227965
Complexity
227
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
2.1
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CatalogNumber: AA86315
ChemicalName: 2-Bromo-4-nitrobenzoic acid
CasNumber: 16426-64-5
MolecularFormula: C7H4BrNO4
MolecularWeight: 246.015
MdlNumber: MFCD00234252
Smiles: OC(=O)c1ccc(cc1Br)[N+](=O)[O-]
NscNumber: 227965
Complexity: 227
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 2.1
CatalogNumber:
AA86315
ChemicalName:
2-Bromo-4-nitrobenzoic acid
CasNumber:
16426-64-5
MolecularFormula:
C7H4BrNO4
MolecularWeight:
246.015
MdlNumber:
MFCD00234252
Smiles:
OC(=O)c1ccc(cc1Br)[N+](=O)[O-]
NscNumber:
227965
Complexity:
227
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
2.1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCCNS(=O)(=O)[NH-].[Na+]
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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__
ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
CCCNS(=O)(=O)[NH-].[Na+]
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: F[P-](F)(F)(F)(F)F.CN1CC[NH+](C1F)C
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
F[P-](F)(F)(F)(F)F.CN1CC[NH+](C1F)C
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: F[P-](F)(F)(F)(F)F.FC(=[N+]1CCCC1)N1CCCC1
NscNumber: __
Complexity: 228
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
F[P-](F)(F)(F)(F)F.FC(=[N+]1CCCC1)N1CCCC1
NscNumber:
__
Complexity:
228
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__