BENZYLAMINE, N-METHYL-p-NITRO-N-NITROSO-
Basic information
- CAS
84174-24-3- Standard SMILES
CN(Cc1ccc([N+](=O)[O-])cc1)N=O- InChIKey
ILORRQUFQKFPBB-UHFFFAOYSA-N- Molecular formula
- C8H9N3O3
- Average molar mass
- 195.18 g/mol
- Monoisotopic mass
- 195.06439116
Names & identifiers
- Preferred name
- BENZYLAMINE, N-METHYL-p-NITRO-N-NITROSO-
- IUPAC
- N-methyl-N-[(4-nitrophenyl)methyl]nitrous amide
- English name
- N-Methyl-N-nitroso-p-nitrobenzylamine
- Molecular weight
- 0
Names & synonyms
84174-24-3BENZYLAMINE, N-METHYL-p-NITRO-N-NITROSO-N-Nitroso-N-(4-nitrobenzyl)methylamineY64JWE82X8N-Methyl-p-nitro-N-nitroso benzylamineBenzenemethanamine, N-methyl-4-nitro-N-nitroso-CCRIS 2574N-Nitroso-N-(p-nitrobenzyl)methylamineN-Nitrosomethyl-4-nitrobenzylamineN-Methyl-p-nitro-N-nitrosobenzylamineBRN 5530387N-methyl-N-[(4-nitrophenyl)methyl]nitrous amide
Show more names
N-Methyl-N-nitroso-p-nitrobenzylamine
Nitrosamines Impurity 36UNII-Y64JWE82X8CHEMBL106032DTXSID60879411
Database identifiers
- CAS
84174-24-3- PubChem CID
- 55206
- DTXSID
DTXSID60879411- ChEMBL
CHEMBL106032- UNII
- Y64JWE82X8
- Nikkaji
- J66.057D
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 78.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 208
Experimental & physicochemical properties
LogP0.82
Physicochemical properties
- FDA UNII
- 64 JWE82X8 · Y64JWE82X8
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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