AA36909
1263283-00-6 | Methyl 4-fluoro-2-hydroxy-3-nitrobenzoate
Manufacturer: A2B Chem
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CatalogNumber
AA36909
ChemicalName
Methyl 4-fluoro-2-hydroxy-3-nitrobenzoate
CasNumber
1263283-00-6
MolecularFormula
C8H6FNO5
MolecularWeight
215.1353
MdlNumber
MFCD18074446
Smiles
COC(=O)c1ccc(c(c1O)[N+](=O)[O-])F
Complexity
266
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
6
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
1.9
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CatalogNumber: AA36909
ChemicalName: Methyl 4-fluoro-2-hydroxy-3-nitrobenzoate
CasNumber: 1263283-00-6
MolecularFormula: C8H6FNO5
MolecularWeight: 215.1353
MdlNumber: MFCD18074446
Smiles: COC(=O)c1ccc(c(c1O)[N+](=O)[O-])F
Complexity: 266
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 1.9
CatalogNumber:
AA36909
ChemicalName:
Methyl 4-fluoro-2-hydroxy-3-nitrobenzoate
CasNumber:
1263283-00-6
MolecularFormula:
C8H6FNO5
MolecularWeight:
215.1353
MdlNumber:
MFCD18074446
Smiles:
COC(=O)c1ccc(c(c1O)[N+](=O)[O-])F
Complexity:
266
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
1.9
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Smiles: CCCCOc1ccc(cc1)NC(=O)n1nc(c2c1ccc(c2)[N+](=O)[O-])N
Complexity: __
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Smiles:
CCCCOc1ccc(cc1)NC(=O)n1nc(c2c1ccc(c2)[N+](=O)[O-])N
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Smiles: [O-][N+](=O)c1ccc2c(c1)c(N)nn2C(=O)Nc1ccc(cc1)Cc1ccccc1
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Smiles:
[O-][N+](=O)c1ccc2c(c1)c(N)nn2C(=O)Nc1ccc(cc1)Cc1ccccc1
Complexity:
__
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Smiles: CCc1c(Cl)nc(nc1Cl)S(=O)(=O)C
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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:
CCc1c(Cl)nc(nc1Cl)S(=O)(=O)C
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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