AF87354
353281-15-9 | 2-Chloro-3-nitropyridine-4-carboxylic acid
Manufacturer: A2B Chem
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CatalogNumber
AF87354
ChemicalName
2-Chloro-3-nitropyridine-4-carboxylic acid
CasNumber
353281-15-9
MolecularFormula
C6H3ClN2O4
MolecularWeight
202.552
MdlNumber
MFCD01928336
Smiles
[O-][N+](=O)c1c(Cl)nccc1C(=O)O
Complexity
229
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
1.2
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CatalogNumber: AF87354
ChemicalName: 2-Chloro-3-nitropyridine-4-carboxylic acid
CasNumber: 353281-15-9
MolecularFormula: C6H3ClN2O4
MolecularWeight: 202.552
MdlNumber: MFCD01928336
Smiles: [O-][N+](=O)c1c(Cl)nccc1C(=O)O
Complexity: 229
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 1.2
CatalogNumber:
AF87354
ChemicalName:
2-Chloro-3-nitropyridine-4-carboxylic acid
CasNumber:
353281-15-9
MolecularFormula:
C6H3ClN2O4
MolecularWeight:
202.552
MdlNumber:
MFCD01928336
Smiles:
[O-][N+](=O)c1c(Cl)nccc1C(=O)O
Complexity:
229
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
1.2
CatalogNumber: AF87355
ChemicalName: 2-Chloro-4-methoxy-5-nitro-benzoic acid
CasNumber: 33458-99-0
MolecularFormula: C8H6ClNO5
MolecularWeight: 231.5899
MdlNumber: MFCD26395064
Smiles: COc1cc(Cl)c(cc1[N+](=O)[O-])C(=O)O
Complexity: 266
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 1.9
CatalogNumber:
AF87355
ChemicalName:
2-Chloro-4-methoxy-5-nitro-benzoic acid
CasNumber:
33458-99-0
MolecularFormula:
C8H6ClNO5
MolecularWeight:
231.5899
MdlNumber:
MFCD26395064
Smiles:
COc1cc(Cl)c(cc1[N+](=O)[O-])C(=O)O
Complexity:
266
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
1.9
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Smiles: Cc1cccc2n1c(Cl)cn2
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Smiles:
Cc1cccc2n1c(Cl)cn2
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Smiles: O=Cc1ccc(cc1Cl)N
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Smiles:
O=Cc1ccc(cc1Cl)N
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Covalently-bondedUnitCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
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