AI40261
1820608-82-9 | 2,4-Dibromo-3-methyl-6-nitrobenzoic acid
Manufacturer: A2B Chem
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CatalogNumber
AI40261
ChemicalName
2,4-Dibromo-3-methyl-6-nitrobenzoic acid
CasNumber
1820608-82-9
MolecularFormula
C8H5Br2NO4
MolecularWeight
338.9376
MdlNumber
MFCD28143929
Smiles
[O-][N+](=O)c1cc(Br)c(c(c1C(=O)O)Br)C
Complexity
280
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
3
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CatalogNumber: AI40261
ChemicalName: 2,4-Dibromo-3-methyl-6-nitrobenzoic acid
CasNumber: 1820608-82-9
MolecularFormula: C8H5Br2NO4
MolecularWeight: 338.9376
MdlNumber: MFCD28143929
Smiles: [O-][N+](=O)c1cc(Br)c(c(c1C(=O)O)Br)C
Complexity: 280
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 3
CatalogNumber:
AI40261
ChemicalName:
2,4-Dibromo-3-methyl-6-nitrobenzoic acid
CasNumber:
1820608-82-9
MolecularFormula:
C8H5Br2NO4
MolecularWeight:
338.9376
MdlNumber:
MFCD28143929
Smiles:
[O-][N+](=O)c1cc(Br)c(c(c1C(=O)O)Br)C
Complexity:
280
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCCCN(C(=O)OCC1C2=CC=CC=C2C3=CC=CC=C13)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
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:
CCCCN(C(=O)OCC1C2=CC=CC=C2C3=CC=CC=C13)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COc1ccc(cc1)c1cc(cc(c1)C(F)(F)F)C(=O)OC
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COc1ccc(cc1)c1cc(cc(c1)C(F)(F)F)C(=O)OC
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
__
RotatableBondCount:
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Xlogp3:
__
CatalogNumber: AI40264
ChemicalName: 5-Bromo-4-chloro-2-nitrobenzamide
CasNumber: 1820608-87-4
MolecularFormula: C7H4BrClN2O3
MolecularWeight: 279.4753
MdlNumber: MFCD28127174
Smiles: NC(=O)c1cc(Br)c(cc1[N+](=O)[O-])Cl
Complexity: 258
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 1.9
CatalogNumber:
AI40264
ChemicalName:
5-Bromo-4-chloro-2-nitrobenzamide
CasNumber:
1820608-87-4
MolecularFormula:
C7H4BrClN2O3
MolecularWeight:
279.4753
MdlNumber:
MFCD28127174
Smiles:
NC(=O)c1cc(Br)c(cc1[N+](=O)[O-])Cl
Complexity:
258
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
1.9