AG71779
59288-43-6 | 5-Hydroxy-6-nitronicotinic acid
Manufacturer: A2B Chem
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CatalogNumber
AG71779
ChemicalName
5-Hydroxy-6-nitronicotinic acid
CasNumber
59288-43-6
MolecularFormula
C6H4N2O5
MolecularWeight
184.1064
MdlNumber
MFCD11044358
Smiles
[O-][N+](=O)c1ncc(cc1O)C(=O)O
Complexity
226
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
6
HydrogenBondDonorCount
2
RotatableBondCount
1
Xlogp3
0.7
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CatalogNumber: AG71779
ChemicalName: 5-Hydroxy-6-nitronicotinic acid
CasNumber: 59288-43-6
MolecularFormula: C6H4N2O5
MolecularWeight: 184.1064
MdlNumber: MFCD11044358
Smiles: [O-][N+](=O)c1ncc(cc1O)C(=O)O
Complexity: 226
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 2
RotatableBondCount: 1
Xlogp3: 0.7
CatalogNumber:
AG71779
ChemicalName:
5-Hydroxy-6-nitronicotinic acid
CasNumber:
59288-43-6
MolecularFormula:
C6H4N2O5
MolecularWeight:
184.1064
MdlNumber:
MFCD11044358
Smiles:
[O-][N+](=O)c1ncc(cc1O)C(=O)O
Complexity:
226
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
2
RotatableBondCount:
1
Xlogp3:
0.7
CatalogNumber: __
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MolecularFormula: __
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Smiles: Brc1ccc(cc1)C(=O)c1cccc(c1)[N+](=O)[O-]
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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MolecularWeight:
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Smiles:
Brc1ccc(cc1)C(=O)c1cccc(c1)[N+](=O)[O-]
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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RotatableBondCount:
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Smiles: CCP(=O)(OCC(F)(F)F)OCC(F)(F)F
Complexity: __
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MolecularWeight:
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Smiles:
CCP(=O)(OCC(F)(F)F)OCC(F)(F)F
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
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ChemicalName: __
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MolecularFormula: __
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Smiles: Cc1ccc(cc1)C(=O)c1ccccc1Cl
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Cc1ccc(cc1)C(=O)c1ccccc1Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__