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CAS Number: 1849-54-3
3-hydroxyisonicotinaldehyde

Structure

3-hydroxyisonicotinaldehyde
Name: 3-hydroxyisonicotinaldehyde
Synonyms:
General Information
Product Number: 1849543

CAS Registry Number 1849-54-3
Name:
4-​Pyridinecarboxaldehy​de, 3-​hydroxy-
Isonicotinaldehyde, 3-hydroxy- (6CI,7CI,8CI)
3-Hydroxy-4-formylpyridine
3-Hydroxy-4-pyridinealdehyde
3-Hydroxy-4-pyridinecarboxaldehyde
4-Formyl-3-hydroxypyridine

 

Chemical Formula: C6H5NO2
Exact Mass: 123.03
Molecular Weight: 123.11
m/z: 123.03 (100.0%), 124.04 (6.6%)

 

InChI:InChI=1S/C6H5NO2/c8-4-5-1-2-7-3-6(5)9/h1-4,9H

InChI Key:NVLPDIRQWJSXLZ-UHFFFAOYSA-N

Canonical SMILES:C1=CN=CC(=C1C=O)O

 

Thermal Properties Value Condition Note
Melting Point 133-134 °C   (2)CAS
Melting Point 126-128 °C   (3)CAS
Melting Point 126-128 °C   (4)IC
Melting Point 123 °C Solv: chloroform (67-66-3); hexane (110-54-3) (1)ACD
Melting Point 112-113 °C (sublm)   (1)ACD

Specification

98%

References
  1. (1) Sanz, Dionisia; Tetrahedron 2005, V61(1), P145-154 CAPLUS
  2. (2) Heinert, Dietrich; Journal of the American Chemical Society 1959, V81, P3933-43 CAPLUS
  3. (3) Heinert, Dietrich; Tetrahedron 1958, V3, P49-61 CAPLUS
  4. (4) Dejardin, Jean Victor; Bulletin de la Societe Chimique de France 1978, (1-2, Pt. 2), P72-4 CAPLUS
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