{2-[4-Chloro-3-(trifluoromethyl)phenyl]-1,3-benzoxazol-6-yl}methanol

HCID 68453052CAS 820241-12-1

Basic information

Standard SMILES
OCc1ccc2nc(-c3ccc(Cl)c(C(F)(F)F)c3)oc2c1
InChIKey
RDXORKWPWSCIHD-UHFFFAOYSA-N
Molecular formula
C15H9ClF3NO2
Average molar mass
327.68 g/mol
Monoisotopic mass
327.0273907

Names & identifiers

Preferred name
{2-[4-Chloro-3-(trifluoromethyl)phenyl]-1,3-benzoxazol-6-yl}methanol
IUPAC
[2-[4-chloro-3-(trifluoromethyl)phenyl]-1,3-benzoxazol-6-yl]methanol

Names & synonyms

820241-12-1(2-(4-Chloro-3-(trifluoromethyl)phenyl)benzo[d]oxazol-6-yl)methanol{2-[4-Chloro-3-(trifluoromethyl)phenyl]-1,3-benzoxazol-6-yl}methanolSCHEMBL2946470DTXSID40738375[2-(4-chloro-3-trifluoromethyl-phenyl)-benzooxazol-6-yl]-methanol

Database identifiers

CAS
820241-12-1
PubChem CID
68453052
DTXSID
DTXSID40738375

Properties

Computed structural properties

XLogP
4.1
Topological polar surface area
46.3 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
6
Rotatable bonds
2
Heavy atoms
22

Related reactions

3 records

Linked notes

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