AB72923
941294-15-1 | Dimethyl 2-(5-methyl-2,4-dinitrophenyl)malonate
Manufacturer: A2B Chem
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CatalogNumber
AB72923
ChemicalName
Dimethyl 2-(5-methyl-2,4-dinitrophenyl)malonate
CasNumber
941294-15-1
MolecularFormula
C12H12N2O8
MolecularWeight
312.2323
MdlNumber
MFCD09475811
Smiles
COC(=O)C(c1cc(C)c(cc1[N+](=O)[O-])[N+](=O)[O-])C(=O)OC
Complexity
453
Covalently-bondedUnitCount
1
HeavyAtomCount
22
HydrogenBondAcceptorCount
8
RotatableBondCount
5
Xlogp3
1.9
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CatalogNumber: AB72923
ChemicalName: Dimethyl 2-(5-methyl-2,4-dinitrophenyl)malonate
CasNumber: 941294-15-1
MolecularFormula: C12H12N2O8
MolecularWeight: 312.2323
MdlNumber: MFCD09475811
Smiles: COC(=O)C(c1cc(C)c(cc1[N+](=O)[O-])[N+](=O)[O-])C(=O)OC
Complexity: 453
Covalently-bondedUnitCount: 1
HeavyAtomCount: 22
HydrogenBondAcceptorCount: 8
RotatableBondCount: 5
Xlogp3: 1.9
CatalogNumber:
AB72923
ChemicalName:
Dimethyl 2-(5-methyl-2,4-dinitrophenyl)malonate
CasNumber:
941294-15-1
MolecularFormula:
C12H12N2O8
MolecularWeight:
312.2323
MdlNumber:
MFCD09475811
Smiles:
COC(=O)C(c1cc(C)c(cc1[N+](=O)[O-])[N+](=O)[O-])C(=O)OC
Complexity:
453
Covalently-bondedUnitCount:
1
HeavyAtomCount:
22
HydrogenBondAcceptorCount:
8
RotatableBondCount:
5
Xlogp3:
1.9
CatalogNumber: __
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Smiles: COC(=O)c1ccc(cc1NS(=O)(=O)c1ccccc1)C(=O)OC
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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Smiles:
COC(=O)c1ccc(cc1NS(=O)(=O)c1ccccc1)C(=O)OC
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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RotatableBondCount:
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Xlogp3:
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MolecularFormula: __
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Smiles: COC(=O)OCCOC(=O)OC
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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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:
COC(=O)OCCOC(=O)OC
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
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Smiles: COC(=O)C(CCCC(C(=O)OC)Br)Br
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(=O)C(CCCC(C(=O)OC)Br)Br
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__