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CAS Number: 118313-35-2
5-methoxyisoquinolin-1(2H)-one

Structure

5-methoxyisoquinolin-1(2H)-one
Name: 5-methoxyisoquinolin-1(2H)-one
Synonyms:
General Information
Product Number: 118313352

CAS Registry Number 118313-35-2
Name:
1(2H)?-?Isoquinolinone, 5-?methoxy-
5-Methoxy-2H-isoquinolin-1-one

 

Chemical Formula: C10H9NO2
Exact Mass: 175.06
Molecular Weight: 175.18
m/z: 175.06 (100.0%), 176.07 (11.0%)

 

InChI:InChI=1S/C10H9NO2/c1-13-9-4-2-3-8-7(9)5-6-11-10(8)12/h2-6H,1H3,(H,11,12)

InChI Key:JTIMZAUBSBUCNK-UHFFFAOYSA-N

Canonical SMILES:COC1=CC=CC2=C1C=CNC2=O

 

Thermal Properties Value Condition Note
Melting Point 222-224 °C Solv: ethyl acetate (141-78-6) (1)CAS

Specification

98%

References
  1. (1) Chuang, Ta-Hsien; Journal of the Chinese Chemical Society (Taipei, Taiwan) 2006, V53(2), P413-420 CAPLUS
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