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CAS Number: 78593-40-5
3-ethynylquinoline

Structure

3-ethynylquinoline
Name: 3-ethynylquinoline
Synonyms:
General Information
Product Number: 78593405

CAS Registry Number 78593-40-5
Name:
Quinoline, 3-?ethynyl-
3-Ethynylquinoline
3-Quinolylacetylene

 

Chemical Formula: C11H7N
Exact Mass: 153.06
Molecular Weight: 153.18
m/z: 153.06 (100.0%), 154.06 (12.0%)

 

InChI:InChI=1S/C11H7N/c1-2-9-7-10-5-3-4-6-11(10)12-8-9/h1,3-8H

InChI Key:ASBDHAOKWPWQMZ-UHFFFAOYSA-N

Canonical SMILES:C#CC1=CC2=CC=CC=C2N=C1

 

Thermal Properties Value Condition Note
Melting Point 82-83 °C   (3)IC
Melting Point 82-83 °C Solv: ligroine (8032-32-4) (2)IC
Melting Point 80.0-80.5 °C   (6)CAS
Melting Point 78-79 °C   (4)CAS

Specification

98%

References
  1. (2) Ames, D. E.; Synthesis 1981, (5), P364-5 CAPLUS
  2. (3) Sakamoto, Takao; Synthesis 1983, (4), P312-14 CAPLUS
  3. (4) Rodriguez, J. Gonzalo; Tetrahedron 2005, V61(38), P9042-9051 CAPLUS
  4. (6) Haug, Ulrich; Chemische Berichte 1960, V93, P593-8 CAPLUS
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