AA86232
164161-49-3 | Methyl 5-benzyloxy-4-methoxy-2-nitrobenzoate
Manufacturer: A2B Chem
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CatalogNumber
AA86232
ChemicalName
Methyl 5-benzyloxy-4-methoxy-2-nitrobenzoate
CasNumber
164161-49-3
MolecularFormula
C16H15NO6
MolecularWeight
317.2934
MdlNumber
MFCD17168894
Smiles
COC(=O)c1cc(OCc2ccccc2)c(cc1[N+](=O)[O-])OC
Complexity
404
Covalently-bondedUnitCount
1
HeavyAtomCount
23
HydrogenBondAcceptorCount
6
RotatableBondCount
6
Xlogp3
3
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CatalogNumber: AA86232
ChemicalName: Methyl 5-benzyloxy-4-methoxy-2-nitrobenzoate
CasNumber: 164161-49-3
MolecularFormula: C16H15NO6
MolecularWeight: 317.2934
MdlNumber: MFCD17168894
Smiles: COC(=O)c1cc(OCc2ccccc2)c(cc1[N+](=O)[O-])OC
Complexity: 404
Covalently-bondedUnitCount: 1
HeavyAtomCount: 23
HydrogenBondAcceptorCount: 6
RotatableBondCount: 6
Xlogp3: 3
CatalogNumber:
AA86232
ChemicalName:
Methyl 5-benzyloxy-4-methoxy-2-nitrobenzoate
CasNumber:
164161-49-3
MolecularFormula:
C16H15NO6
MolecularWeight:
317.2934
MdlNumber:
MFCD17168894
Smiles:
COC(=O)c1cc(OCc2ccccc2)c(cc1[N+](=O)[O-])OC
Complexity:
404
Covalently-bondedUnitCount:
1
HeavyAtomCount:
23
HydrogenBondAcceptorCount:
6
RotatableBondCount:
6
Xlogp3:
3
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MolecularFormula: __
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Smiles: O=C1N(NC(=O)C21CCCCC2)c1ccccc1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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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(NC(=O)C21CCCCC2)c1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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ChemicalName: __
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MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=c1[nH]c(=O)[nH]cc1S(=O)(=O)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
O=c1[nH]c(=O)[nH]cc1S(=O)(=O)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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ChemicalName: __
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MolecularFormula: __
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Smiles: CCCCCCC/C=C/CCCCCC
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCCCCCC/C=C/CCCCCC
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__