AG27367
55076-32-9 | Methyl 3-hydroxy-5-nitrobenzoate
Manufacturer: A2B Chem
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CatalogNumber
AG27367
ChemicalName
Methyl 3-hydroxy-5-nitrobenzoate
CasNumber
55076-32-9
MolecularFormula
C8H7NO5
MolecularWeight
197.14487999999997
MdlNumber
MFCD00463877
Smiles
COC(=O)c1cc(O)cc(c1)[N+](=O)[O-]
NscNumber
44299
Complexity
236
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
1.7
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CatalogNumber: AG27367
ChemicalName: Methyl 3-hydroxy-5-nitrobenzoate
CasNumber: 55076-32-9
MolecularFormula: C8H7NO5
MolecularWeight: 197.14487999999997
MdlNumber: MFCD00463877
Smiles: COC(=O)c1cc(O)cc(c1)[N+](=O)[O-]
NscNumber: 44299
Complexity: 236
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 1.7
CatalogNumber:
AG27367
ChemicalName:
Methyl 3-hydroxy-5-nitrobenzoate
CasNumber:
55076-32-9
MolecularFormula:
C8H7NO5
MolecularWeight:
197.14487999999997
MdlNumber:
MFCD00463877
Smiles:
COC(=O)c1cc(O)cc(c1)[N+](=O)[O-]
NscNumber:
44299
Complexity:
236
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
1.7
CatalogNumber: __
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MolecularWeight: __
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Smiles: O=C1N=c2c(=C1)cc(c(c2)Br)[N+](=O)[O-]
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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__
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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:
O=C1N=c2c(=C1)cc(c(c2)Br)[N+](=O)[O-]
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: [O-][N+](=O)c1cccc2c1c(Cl)n[nH]2
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
[O-][N+](=O)c1cccc2c1c(Cl)n[nH]2
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C1Cc2c(N1)c(C)ccn2
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C1Cc2c(N1)c(C)ccn2
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__