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CAS Number: 31803-00-6
5-benzyl-1,3,4-oxadiazol-2-amine

Structure

5-benzyl-1,3,4-oxadiazol-2-amine
Name: 5-benzyl-1,3,4-oxadiazol-2-amine
Synonyms:
General Information
Product Number: 31803006

CAS Registry Number 31803-00-6
Name:
1,?3,?4-?Oxadiazol-?2-?amine, 5-?(phenylmethyl)?-
1,3,4-Oxadiazole, 2-amino-5-benzyl- (6CI,7CI,8CI)
5-(Phenylmethyl)-1,3,4-oxadiazol-2-amine
2-Amino-5-benzyl-1,3,4-oxadiazole

 

Chemical Formula: C9H9N3O
Exact Mass: 175.07
Molecular Weight: 175.19
m/z: 175.07 (100.0%), 176.08 (9.9%), 176.07 (1.1%)

 

InChI:InChI=1S/C9H9N3O/c10-9-12-11-8(13-9)6-7-4-2-1-3-5-7/h1-5H,6H2,(H2,10,12)

InChI Key:UEHXUDSFIIVUNO-UHFFFAOYSA-N

Canonical SMILES:C1=CC=C(C=C1)CC2=NN=C(O2)N

 

Thermal Properties Value Condition Note
Melting Point 158-159 °C Solv: water (7732-18-5) (2)CAS
Melting Point See full text   (3)CAS

Specification

98%

References
  1. (2) Gehlen, Heinz; Justus Liebigs Annalen der Chemie 1962, V660, P144-7 CAPLUS
  2. (3) Maggio, Francesco; Annali di Chimica (Rome, Italy) 1960, V50, P491-504 CAPLUS
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