Basic information
- CAS
346723-23-7- Standard SMILES
CCc1ccccc1NC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1- InChIKey
JKJMFBLXPHUQNY-UHFFFAOYSA-N- Molecular formula
- C15H13N3O5
- Average molar mass
- 315.28 g/mol
- Monoisotopic mass
- 315.08552052
Names & identifiers
- Preferred name
- N-(2-ethylphenyl)-3,5-dinitrobenzamide
- IUPAC
- N-(2-ethylphenyl)-3,5-dinitrobenzamide
Names & synonyms
N-(2-ethylphenyl)-3,5-dinitrobenzamideOprea1_538143Oprea1_724622346723-23-7DTXSID001282104STK064660AKOS002944241ST45136108(3,5-dinitrophenyl)-N-(2-ethylphenyl)carboxamide
Database identifiers
- CAS
346723-23-7- PubChem CID
- 3692888
- DTXSID
DTXSID001282104
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 121 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 437
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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