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CAS Number: 5790-90-9
5-chloro-3-methylbenzo[d]oxazol-2(3H)-one

Structure

 5-chloro-3-methylbenzo[d]oxazol-2(3H)-one
Name: 5-chloro-3-methylbenzo[d]oxazol-2(3H)-one
Synonyms:
General Information
Product Number: 5790909

CAS Registry Number 5790-90-9
Name:
2(3H)?-?Benzoxazolone, 5-?chloro-?3-?methyl-
2-Benzoxazolinone, 5-chloro-3-methyl- (6CI,7CI,8CI)
5-Chloro-3-methylbenzoxazolin-2-one
NSC 24960

 

Chemical Formula: C8H6ClNO2
Exact Mass: 183.01
Molecular Weight: 183.59
m/z: 183.01 (100.0%), 185.01 (32.4%), 184.01 (9.2%), 186.01 (2.8%)

 

InChI:InChI=1S/C8H6ClNO2/c1-10-6-4-5(9)2-3-7(6)12-8(10)11/h2-4H,1H3

InChI Key:VORWOQGVKPXSCM-UHFFFAOYSA-N

Canonical SMILES:CN1C2=C(C=CC(=C2)Cl)OC1=O

 

Thermal Properties Value Condition Note
Melting Point 133.5-134.0 °C   (2)CAS
Melting Point 132-133 °C   (3)CAS

Specification

98%
References
  1. (2) Sam, J.; Journal of Organic Chemistry 1958, V23, P1500-3 CAPLUS
  2. (3) Toyoshima, Shoji; Yakugaku Zasshi 1966, V86(3), P203-9 CAPLUS
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