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CAS Number: 934389-18-1
7-methoxyisoindolin-1-one

Structure

7-methoxyisoindolin-1-one
Name: 7-methoxyisoindolin-1-one
Synonyms:
General Information
Product Number: 934389181

CAS Registry Number: 934389-18-1

Name:

1H-​Isoindol-​1-​one, 2,​3-​dihydro-​7-​methoxy-
7-​Methoxy-​2,​3-​dihydroisoindol-​1-​one 

 

Chemical Formula: C9H9NO2
Exact Mass: 163.06
Molecular Weight: 163.17
m/z: 163.06 (100.0%), 164.07 (9.9%)
Elemental Analysis: C, 66.25; H, 5.56; N, 8.58; O, 19.61

 

InChI: InChI=1S/C9H9NO2/c1-12-7-4-2-3-6-5-10-9(11)8(6)7/h2-4H,5H2,1H3,(H,10,11)
InChIKey: JHEBWQWNBLZBSG-UHFFFAOYSA-N
Canonical SMILES : COC1=CC=CC2=C1C(=O)NC2

 

Thermal Properties Value Condition Note
Melting Point 144-145 °C Solv: acetonitrile (75-05-8); ethyl ether (60-29-7) (1)CAS

Specification

98%

References
  1. (1) Lamblin, Marc; Tetrahedron 2007, V63(12), P2664-2669 CAPLUS
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