AA64287
14617-85-7 | 4-Nitrophenyl myristate
Manufacturer: A2B Chem
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CatalogNumber
AA64287
ChemicalName
4-Nitrophenyl myristate
CasNumber
14617-85-7
MolecularFormula
C20H31NO4
MolecularWeight
349.4644
MdlNumber
MFCD00047731
Smiles
CCCCCCCCCCCCCC(=O)Oc1ccc(cc1)[N+](=O)[O-]
NscNumber
122044
Complexity
359
Covalently-bondedUnitCount
1
HeavyAtomCount
25
HydrogenBondAcceptorCount
4
RotatableBondCount
14
Xlogp3
7.7
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CatalogNumber: AA64287
ChemicalName: 4-Nitrophenyl myristate
CasNumber: 14617-85-7
MolecularFormula: C20H31NO4
MolecularWeight: 349.4644
MdlNumber: MFCD00047731
Smiles: CCCCCCCCCCCCCC(=O)Oc1ccc(cc1)[N+](=O)[O-]
NscNumber: 122044
Complexity: 359
Covalently-bondedUnitCount: 1
HeavyAtomCount: 25
HydrogenBondAcceptorCount: 4
RotatableBondCount: 14
Xlogp3: 7.7
CatalogNumber:
AA64287
ChemicalName:
4-Nitrophenyl myristate
CasNumber:
14617-85-7
MolecularFormula:
C20H31NO4
MolecularWeight:
349.4644
MdlNumber:
MFCD00047731
Smiles:
CCCCCCCCCCCCCC(=O)Oc1ccc(cc1)[N+](=O)[O-]
NscNumber:
122044
Complexity:
359
Covalently-bondedUnitCount:
1
HeavyAtomCount:
25
HydrogenBondAcceptorCount:
4
RotatableBondCount:
14
Xlogp3:
7.7
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Smiles: COc1cc(OC)ccc1C(=O)CCC(=O)O
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Complexity: __
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Smiles:
COc1cc(OC)ccc1C(=O)CCC(=O)O
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Smiles: COc1ccc(c(c1)O)C(=O)CCC(=O)O
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Smiles:
COc1ccc(c(c1)O)C(=O)CCC(=O)O
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HeavyAtomCount:
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Smiles: C[C@H]1OC(=O)[C@@H]([C@H]([C@@H]1OCc1ccccc1)OCc1ccccc1)OCc1ccccc1
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__
ChemicalName:
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CasNumber:
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MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
C[C@H]1OC(=O)[C@@H]([C@H]([C@@H]1OCc1ccccc1)OCc1ccccc1)OCc1ccccc1
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__