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CAS Number: 435273-34-0
1-oxoisoindoline-4-carbonitrile

Structure

1-oxoisoindoline-4-carbonitrile
Name: 1-oxoisoindoline-4-carbonitrile
Synonyms:
General Information
Product Number: 435273340

CAS Registry Number 435273-34-0
Name:
1H-​Isoindole-​4-​carbonitrile, 2,​3-​dihydro-​1-​oxo-
1-Oxo-4-isoindolinecarbonitrile

 

Chemical Formula: C9H6N2O
Exact Mass: 158.05
Molecular Weight: 158.16
m/z: 158.05 (100.0%), 159.05 (10.6%)

 

InChI:InChI=1S/C9H6N2O/c10-4-6-2-1-3-7-8(6)5-11-9(7)12/h1-3H,5H2,(H,11,12)

InChI Key:BEUNOHDSYZHSFZ-UHFFFAOYSA-N

Canonical SMILES:C1C2=C(C=CC=C2C(=O)N1)C#N

Specification

98%

References

PCT Int. Appl. (2011), WO 2011075515 A1 20110623. 

PCT Int. Appl. (2002), WO 2002046186 A1 20020613.

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