AD30841
4033-88-9 | Dimethyl 2-(4-nitrophenyl)malonate
Manufacturer: A2B Chem
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CatalogNumber
AD30841
ChemicalName
Dimethyl 2-(4-nitrophenyl)malonate
CasNumber
4033-88-9
MolecularFormula
C11H11NO6
MolecularWeight
253.2081
MdlNumber
MFCD03425806
Smiles
COC(=O)C(c1ccc(cc1)[N+](=O)[O-])C(=O)OC
Complexity
313
Covalently-bondedUnitCount
1
HeavyAtomCount
18
HydrogenBondAcceptorCount
6
RotatableBondCount
5
Xlogp3
1.7
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CatalogNumber: AD30841
ChemicalName: Dimethyl 2-(4-nitrophenyl)malonate
CasNumber: 4033-88-9
MolecularFormula: C11H11NO6
MolecularWeight: 253.2081
MdlNumber: MFCD03425806
Smiles: COC(=O)C(c1ccc(cc1)[N+](=O)[O-])C(=O)OC
Complexity: 313
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 6
RotatableBondCount: 5
Xlogp3: 1.7
CatalogNumber:
AD30841
ChemicalName:
Dimethyl 2-(4-nitrophenyl)malonate
CasNumber:
4033-88-9
MolecularFormula:
C11H11NO6
MolecularWeight:
253.2081
MdlNumber:
MFCD03425806
Smiles:
COC(=O)C(c1ccc(cc1)[N+](=O)[O-])C(=O)OC
Complexity:
313
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
6
RotatableBondCount:
5
Xlogp3:
1.7
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Smiles: NC1CC(C)(C)N(C(C1)(C)C)C
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
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Xlogp3: __
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Smiles:
NC1CC(C)(C)N(C(C1)(C)C)C
Complexity:
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__
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RotatableBondCount:
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Smiles: ClC(=O)c1ccc(cc1F)[N+](=O)[O-]
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Smiles:
ClC(=O)c1ccc(cc1F)[N+](=O)[O-]
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
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Xlogp3:
__
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Smiles: CCC(COC(=O)c1ccccc1C(=O)O)CCC(=O)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCC(COC(=O)c1ccccc1C(=O)O)CCC(=O)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__