AI51355
50445-50-6 | N-Ethyl-4-nitrobenzamide
Manufacturer: A2B Chem
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CatalogNumber
AI51355
ChemicalName
N-Ethyl-4-nitrobenzamide
CasNumber
50445-50-6
MolecularFormula
C9H10N2O3
MolecularWeight
194.1873
MdlNumber
MFCD01211872
Smiles
CCNC(=O)c1ccc(cc1)[N+](=O)[O-]
NscNumber
406844
Complexity
217
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
1.3
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CatalogNumber: AI51355
ChemicalName: N-Ethyl-4-nitrobenzamide
CasNumber: 50445-50-6
MolecularFormula: C9H10N2O3
MolecularWeight: 194.1873
MdlNumber: MFCD01211872
Smiles: CCNC(=O)c1ccc(cc1)[N+](=O)[O-]
NscNumber: 406844
Complexity: 217
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 1.3
CatalogNumber:
AI51355
ChemicalName:
N-Ethyl-4-nitrobenzamide
CasNumber:
50445-50-6
MolecularFormula:
C9H10N2O3
MolecularWeight:
194.1873
MdlNumber:
MFCD01211872
Smiles:
CCNC(=O)c1ccc(cc1)[N+](=O)[O-]
NscNumber:
406844
Complexity:
217
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
1.3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=Cc1sc2c(c1C)cc(cc2)Cl
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=Cc1sc2c(c1C)cc(cc2)Cl
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: NCC(CN(Cc1ccccc1)Cc1ccccc1)O
NscNumber: __
Complexity: 227
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 1.7
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
NCC(CN(Cc1ccccc1)Cc1ccccc1)O
NscNumber:
__
Complexity:
227
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
1.7
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCOC(=O)c1nccc2c1cccc2
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCOC(=O)c1nccc2c1cccc2
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__