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CAS Number: 222036-66-0
5-aminoisoindolin-1-one

Structure

5-aminoisoindolin-1-one
Name: 5-aminoisoindolin-1-one
Synonyms:
General Information
Product Number: 222036660

CAS Registry Number 222036-66-0
Name:
1H-​Isoindol-​1-​one, 5-​amino-​2,​3-​dihydro-
5-Amino-2,3-dihydro-1H-isoindol-1-one
5-Amino-2,3-dihydroisoindol-1-one
5-Aminoisoindolin-1-one

 

Chemical Formula: C8H8N2O
Exact Mass: 148.06
Molecular Weight: 148.16
m/z: 148.06 (100.0%), 149.07 (8.8%)

 

InChI:InChI=1S/C8H8N2O/c9-6-1-2-7-5(3-6)4-10-8(7)11/h1-3H,4,9H2,(H,10,11)

InChI Key:RGJCJWXNNDARPQ-UHFFFAOYSA-N

Canonical SMILES:C1C2=C(C=CC(=C2)N)C(=O)N1

 

Thermal Properties Value Condition Note
Melting Point 197-199 °C Solv: ethyl acetate (141-78-6) (1)CAS

Specification

98%

References
  1. (1) Lal, Bansi; Indian Journal of Chemistry, Section B: Organic Chemistry Including Medicinal Chemistry 2007, V46B(11), P1815-1832 CAPLUS
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