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CAS Number: 14447-03-1
diisopropyl but-2-ynedioate

Structure

diisopropyl but-2-ynedioate
Name: diisopropyl but-2-ynedioate
Synonyms:
General Information
Product Number: 14447031

CAS Registry Number 14447-03-1
Name:
2-​Butynedioic acid, 1,​4-​bis(1-​methylethyl) ester
2-Butynedioic acid, bis(1-methylethyl) ester (9CI)
Acetylenedicarboxylic acid, diisopropyl ester (6CI,8CI)
Diisopropyl acetylenedicarboxylate
Diisopropyl butynedioate

 

Chemical Formula: C10H14O4
Exact Mass: 198.09
Molecular Weight: 198.22
m/z: 198.09 (100.0%), 199.09 (11.0%)

 

InChI:InChI=1S/C10H14O4/c1-7(2)13-9(11)5-6-10(12)14-8(3)4/h7-8H,1-4H3

InChI Key:WGYNZBIFSWZNMA-UHFFFAOYSA-N

Canonical SMILES:CC(C)OC(=O)C#CC(=O)OC(C)C

 

Thermal Properties Value Condition Note
Boiling Point 107 °C Press: 3 Torr (1)CAS
Boiling Point 103 °C Press: 7 Torr (2)IC

Specification

98%

References
  1. (1) Grove, J. F.; Annals of Applied Biology 1948, V35, P37-44 CAPLUS
  2. (2) Zaima, Tadataka; Journal of Heterocyclic Chemistry 1983, V20(1), P1-4 CAPLUS
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