Basic information
- CAS
90110-19-3- Standard SMILES
CN(C(=O)c1ccc(Cl)cc1)[N+](=O)[O-]- InChIKey
BRGGIUASAMPHHO-UHFFFAOYSA-N- Molecular formula
- C8H7ClN2O3
- Average molar mass
- 214.6 g/mol
- Monoisotopic mass
- 214.0145198
Names & identifiers
- Preferred name
- Benzamide, 4-chloro-N-methyl-N-nitro-
- IUPAC
- 4-chloro-N-methyl-N-nitrobenzamide
Names & synonyms
4-chloro-N-methyl-N-nitrobenzamideBenzamide, 4-chloro-N-methyl-N-nitro-90110-19-3DTXSID20403099AKOS024350164ST50974227(4-chlorophenyl)-N-methyl-N-nitrocarboxamide
Database identifiers
- CAS
90110-19-3- PubChem CID
- 4420060
- DTXSID
DTXSID20403099- Nikkaji
- J259.271A
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 66.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 233
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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