Specification
Synonyms
Butyl-PBD,B8378_SIGMA,20526_FLUKA,EINECS239-135-7,NSC158164,ZINC01601801,NSC158164,ST5307390,
IUPAC Name
2-(4-tert-butylphenyl)-5-(4-phenylphenyl)-1,3,4-oxadiazole
Canonical SMILES
CC(C)(C)C1=CC=C(C=C1)C2=NN=C(O2)C3=CC=C(C=C3)C4=CC=CC=C4
InChI
InChI=1S/C24H22N2O/c1-24(2,3)21-15-13-20(14-16-21)23-26-25-22(27-23)19-11-9-18(10-12-19)17-7-5-4-6-8-17/h4-16H,1-3H3
InChI Key
XZCJVWCMJYNSQO-UHFFFAOYSA-N
Boiling Point
137 - 139 °C
Melting Point
505.1 °C at 760mmHg
Safety Description
S24/25
Stability
Stable under normal temperatures and pressures.