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CAS Number: 159053-44-8
2-oxo-1,2,3,4-tetrahydroquinoline-6-carbonitrile

Structure

 2-oxo-1,2,3,4-tetrahydroquinoline-6-carbonitrile
Name: 2-oxo-1,2,3,4-tetrahydroquinoline-6-carbonitrile
Synonyms:
General Information
Product Number: 159053448

CAS Registry Number 159053-44-8
Name:
6-?Quinolinecarbonitril?e, 1,?2,?3,?4-?tetrahydro-?2-?oxo-

 

Chemical Formula: C10H8N2O
Exact Mass: 172.06
Molecular Weight: 172.18
m/z: 172.06 (100.0%), 173.07 (10.9%)

 

InChI:InChI=1S/C10H8N2O/c11-6-7-1-3-9-8(5-7)2-4-10(13)12-9/h1,3,5H,2,4H2,(H,12,13)

InChI Key:JLJAWZROXAVJMK-UHFFFAOYSA-N

Canonical SMILES:C1CC(=O)NC2=C1C=C(C=C2)C#N

 

Thermal Properties Value Condition Note
Melting Point 276-278 °C Solv: acetone (67-64-1) (2)CAS
Melting Point >250 °C   (1)CAS

Specification

98%
References
  1. (1) Tsuritani, Takayuki; Organic Letters 2009, V11(5), P1043-1045 CAPLUS
  2. (2) Zhou, Wang; Tetrahedron 2009, V65(10), P1982-1987 CAPLUS
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