Basic information
- CAS
55407-28-8- Standard SMILES
Nc1ccc(Oc2ccc(C(F)(F)F)cc2Cl)cc1- InChIKey
AKWVJIZRAWAXOU-UHFFFAOYSA-N- Molecular formula
- C13H9ClF3NO
- Average molar mass
- 287.66 g/mol
- Monoisotopic mass
- 287.0324761
Names & identifiers
- Preferred name
- 4-[2-Chloro-4-(trifluoromethyl)phenoxy]aniline
- IUPAC
- 4-[2-chloro-4-(trifluoromethyl)phenoxy]aniline
Names & synonyms
4-[2-chloro-4-(trifluoromethyl)phenoxy]aniline55407-28-8SCHEMBL9582439Benzenamine, 4-[2-chloro-4-(trifluoromethyl)phenoxy]-DTXSID204404844-(2-chloro-4-trifluoromethyl-phenoxy)-aniline
Database identifiers
- CAS
55407-28-8- PubChem CID
- 10469327
- DTXSID
DTXSID20440484
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 35.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 292
Related reactions
7 records
Compound notes
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