Basic information
- CAS
32158-96-6- Standard SMILES
CC(C)(O)CNC(=O)c1ccc([N+](=O)[O-])cc1- InChIKey
NSIIUMUYWPFXIH-UHFFFAOYSA-N- Molecular formula
- C11H14N2O4
- Average molar mass
- 238.24 g/mol
- Monoisotopic mass
- 238.09535693
Names & identifiers
- Preferred name
- n-(2-Hydroxy-2-methylpropyl)-4-nitrobenzamide
- IUPAC
- N-(2-hydroxy-2-methylpropyl)-4-nitrobenzamide
Names & synonyms
32158-96-6n-(2-hydroxy-2-methylpropyl)-4-nitrobenzamideNSC120855DTXSID20298124AKOS014442537NSC-120855DS-006536Benzamide,n-(2-hydroxy-2-methylpropyl)-4-nitro-
Database identifiers
- CAS
32158-96-6- PubChem CID
- 274684
- DTXSID
DTXSID20298124
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 95.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 290
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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