AE33103
1369835-94-8 | 5-Cyano-2-nitrobenzamide
Manufacturer: A2B Chem
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CatalogNumber
AE33103
ChemicalName
5-Cyano-2-nitrobenzamide
CasNumber
1369835-94-8
MolecularFormula
C8H5N3O3
MolecularWeight
191.1436
MdlNumber
MFCD00090235
Smiles
N#Cc1ccc(c(c1)C(=O)N)[N+](=O)[O-]
NscNumber
142033
Complexity
226
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
2
RotatableBondCount
1
Xlogp3
1.3
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CatalogNumber: AE33103
ChemicalName: 5-Cyano-2-nitrobenzamide
CasNumber: 1369835-94-8
MolecularFormula: C8H5N3O3
MolecularWeight: 191.1436
MdlNumber: MFCD00090235
Smiles: N#Cc1ccc(c(c1)C(=O)N)[N+](=O)[O-]
NscNumber: 142033
Complexity: 226
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 1
Xlogp3: 1.3
CatalogNumber:
AE33103
ChemicalName:
5-Cyano-2-nitrobenzamide
CasNumber:
1369835-94-8
MolecularFormula:
C8H5N3O3
MolecularWeight:
191.1436
MdlNumber:
MFCD00090235
Smiles:
N#Cc1ccc(c(c1)C(=O)N)[N+](=O)[O-]
NscNumber:
142033
Complexity:
226
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
1
Xlogp3:
1.3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Nc1n[nH]c2c1nc(cc2)C#N
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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MolecularFormula:
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Smiles:
Nc1n[nH]c2c1nc(cc2)C#N
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Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
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RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O.O.[Cl-].[Cl-].[Cu+2]
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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__
ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
__
MdlNumber:
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Smiles:
O.O.[Cl-].[Cl-].[Cu+2]
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
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RotatableBondCount:
__
Xlogp3:
__
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ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC[C@H]([C@H]([C@@H]([C@H](C=O)N)O)O[C@@H]1O[C@H](CO)[C@@H]([C@@H]([C@H]1O)O)O)O
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
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MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC[C@H]([C@H]([C@@H]([C@H](C=O)N)O)O[C@@H]1O[C@H](CO)[C@@H]([C@@H]([C@H]1O)O)O)O
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__