5-Chloro-3-phenyl-6-(trifluoromethyl)-2,1-benzoxazole
Basic information
- CAS
169517-02-6- Standard SMILES
FC(F)(F)c1cc2noc(-c3ccccc3)c2cc1Cl- InChIKey
KHHBKIZGQPRRPW-UHFFFAOYSA-N- Molecular formula
- C14H7ClF3NO
- Average molar mass
- 297.66 g/mol
Names & identifiers
- Preferred name
- 5-Chloro-3-phenyl-6-(trifluoromethyl)-2,1-benzoxazole
- IUPAC
- 5-chloro-3-phenyl-6-(trifluoromethyl)-2,1-benzoxazole
- English name
- 5-chloro-3-phenyl-6-(trifluoromethyl)-2,1-benzisoxazole
- Molecular formula
- C14H7ClF3NO
- Molecular weight
- 297.6596896
Names & synonyms
5-chloro-3-phenyl-6-(trifluoromethyl)-2,1-benzoxazole3-Phenyl-5-chloro-6-(trifluoromethyl)-2,1-benzisoxazole5-chloro-3-phenyl-6-(trifluoromethyl)-2,1-benzisoxazoleAN-698/14471013
Database identifiers
- CAS
169517-02-6- Nikkaji
- J686.376K
Properties
Computed structural properties
- XLogP
- 4.9
- Topological polar surface area
- 26 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 1
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 346
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…