CAS Registry Number®
939-05-9
CAS Name
5-Phenyl-3(2H)-isoxazolone
Molecular Formula
C9H7NO2
Molecular Mass
161.16
Compound Properties
-
Melting Point (1)
163-164 °C
Source(s)
- (1) Bravo, Pierfrancesco; Gazzetta Chimica Italiana, (1961), 91, 47-64, CAplus
Other Names and Identifiers
InChI
InChI=1S/C9H7NO2/c11-9-6-8(12-10-9)7-4-2-1-3-5-7/h1-6H,(H,10,11)
InChIKey
InChIKey=AFVFIJAYAFTQRB-UHFFFAOYSA-N
SMILES
O=C1C=C(ON1)C2=CC=CC=C2
Canonical SMILES
O=C1C=C(ON1)C=2C=CC=CC2
Other Names for this Substance
- 3(2H)-Isoxazolone, 5-phenyl-
- 3-Isoxazolol, 5-phenyl-
- 4-Isoxazolin-3-one, 5-phenyl-
- 5-Phenyl-3(2H)-isoxazolone
- 3-Hydroxy-5-phenylisoxazole
- 5-Phenyl-3-hydroxyisoxazole
Deleted or Replaced CAS Registry Numbers
29412-90-6
