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CAS Number: 31053-30-2
2,3-dihydroisoquinoline-1,4-dione

Structure

 2,3-dihydroisoquinoline-1,4-dione
Name: 2,3-dihydroisoquinoline-1,4-dione
Synonyms:
General Information
Product Number: 31053302

CAS Registry Number 31053-30-2
Name:
1,?4-?Isoquinolinedione, 2,?3-?dihydro-
1,2,3,4-Tetrahydro-1,4-dioxoisoquinoline
1,2,3,4-Tetrahydro-1,4-isoquinolinedione
1,4(2H,3H)-Isoquinolinedione
1,4-Dioxo-1,2,3,4-tetrahydroisoquinoline

 

Chemical Formula: C9H7NO2
Exact Mass: 161.05
Molecular Weight: 161.16
m/z: 161.05 (100.0%), 162.05 (9.9%)

 

InChI:InChI=1S/C9H7NO2/c11-8-5-10-9(12)7-4-2-1-3-6(7)8/h1-4H,5H2,(H,10,12)

InChI Key:WRRHHSIPJQOVJM-UHFFFAOYSA-N

Canonical SMILES:C1C(=O)C2=CC=CC=C2C(=O)N1

 

Thermal Properties Value Condition Note
Melting Point >300 °C   (1)CAS
Melting Point 255 °C (decomp)   (2)IC

Specification

98%
References
  1. (1) Caswell, Lyman R.; Journal of Organic Chemistry 1961, V26, P4175-7 CAPLUS
  2. (2) Nunami, Kenichi; Chemical & Pharmaceutical Bulletin 1979, V27(6), P1373-7 CAPLUS
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