AC95249
943-14-6 | 2-Bromo-5-nitrobenzoic acid
Manufacturer: A2B Chem
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CatalogNumber
AC95249
ChemicalName
2-Bromo-5-nitrobenzoic acid
CasNumber
943-14-6
MolecularFormula
C7H4BrNO4
MolecularWeight
246.01496
MdlNumber
MFCD00134558
Smiles
[O-][N+](=O)c1ccc(c(c1)C(=O)O)Br
NscNumber
52211
Complexity
227
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
2.1
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CatalogNumber: AC95249
ChemicalName: 2-Bromo-5-nitrobenzoic acid
CasNumber: 943-14-6
MolecularFormula: C7H4BrNO4
MolecularWeight: 246.01496
MdlNumber: MFCD00134558
Smiles: [O-][N+](=O)c1ccc(c(c1)C(=O)O)Br
NscNumber: 52211
Complexity: 227
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 2.1
CatalogNumber:
AC95249
ChemicalName:
2-Bromo-5-nitrobenzoic acid
CasNumber:
943-14-6
MolecularFormula:
C7H4BrNO4
MolecularWeight:
246.01496
MdlNumber:
MFCD00134558
Smiles:
[O-][N+](=O)c1ccc(c(c1)C(=O)O)Br
NscNumber:
52211
Complexity:
227
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
2.1
CatalogNumber: __
ChemicalName: __
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MolecularFormula: __
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Smiles: COCCCCC(=C)CC(C)C
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Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
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RotatableBondCount: __
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Smiles:
COCCCCC(=C)CC(C)C
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Complexity:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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ChemicalName: __
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MolecularFormula: __
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Smiles: OC(=O)c1[nH]c2c(c1c1ccccc1)cccc2
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
OC(=O)c1[nH]c2c(c1c1ccccc1)cccc2
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=Cc1[nH]c2c(c1c1ccccc1)cccc2
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=Cc1[nH]c2c(c1c1ccccc1)cccc2
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__