Basic information
- Standard SMILES
Cc1cc(Cl)c(C(=O)c2ccc(C(F)(F)F)cc2)c(CN=[N+]=[N-])c1- InChIKey
JVWAPUWEZPVKCJ-UHFFFAOYSA-N- Molecular formula
- C16H11ClF3N3O
- Average molar mass
- 353.72 g/mol
- Monoisotopic mass
- 353.0542742
Names & identifiers
- Preferred name
- 2-(4-Trifluoromethylbenzoyl)-3-chloro-5-methylbenzyl azide
- IUPAC
- [2-(azidomethyl)-6-chloro-4-methylphenyl]-[4-(trifluoromethyl)phenyl]methanone
Names & synonyms
2-(4-trifluoromethylbenzoyl)-3-chloro-5-methylbenzyl azide
Database identifiers
- PubChem CID
- 23320968
Properties
Computed structural properties
- XLogP
- 6
- Topological polar surface area
- 31.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 499
Related reactions
2 records
Compound notes
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