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CAS Number: 22960-16-3
isoquinoline-4-carbaldehyde

Structure

isoquinoline-4-carbaldehyde
Name: isoquinoline-4-carbaldehyde
Synonyms:
General Information
Product Number: 22960163
CAS Registry Number: 22960-16-3
Name:
4-​Isoquinolinecarboxal​dehyde
4-​Formylisoquinoline 
 
Chemical Formula: C10H7NO
Exact Mass: 157.05
Molecular Weight: 157.17
m/z: 157.05 (100.0%), 158.06 (10.9%)
Elemental Analysis: C, 76.42; H, 4.49; N, 8.91; O, 10.18
 
InChI: InChI=1S/C10H7NO/c12-7-9-6-11-5-8-3-1-2-4-10(8)9/h1-7H
InChIKey: RNQQJLYJLDQGGL-UHFFFAOYSA-N
Canonical SMILES : C1=CC=C2C(=C1)C=NC=C2C=O
 
Thermal Properties Value Condition Note
Melting Point 103 °C   (3)CAS

Specification

98%

References
  1. (1) Schnopp, Markus; European Journal of Organic Chemistry 2009, (26), P4458-4467 CAPLUS
  2. (2) WSS: Spectral data were obtained from Wiley Subscription Services, Inc. (US)
  3. (3) Angyal, S. J.; Journal of the Chemical Society 1953, P1740-1 CAPLUS
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