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CAS Number: 81053-18-1
ethyl 2-(1-hydroxy-4-oxocyclohexyl)acetate

Structure

 ethyl 2-(1-hydroxy-4-oxocyclohexyl)acetate
Name: ethyl 2-(1-hydroxy-4-oxocyclohexyl)acetate
Synonyms:
General Information
Product Number: 81053181

CAS Registry Number 81053-18-1
Name:
Cyclohexaneacetic acid, 1-?hydroxy-?4-?oxo-?, ethyl ester

 

Chemical Formula: C10H16O4
Exact Mass: 200.10
Molecular Weight: 200.23
m/z: 200.10 (100.0%), 201.11 (11.2%), 202.11 (1.4%)

 

InChI:InChI=1S/C10H16O4/c1-2-14-9(12)7-10(13)5-3-8(11)4-6-10/h13H,2-7H2,1H3

InChI Key:TXSPYNSGSUBIQZ-UHFFFAOYSA-N

Canonical SMILES:CCOC(=O)CC1(CCC(=O)CC1)O

 

Thermal Properties Value Condition Note
Boiling Point 90-110 °C Press: 0.01 Torr (1)CAS

Specification

98%
References
  1. (1) Siegel, A.; Monatshefte fuer Chemie 1957, V88, P910-18 CAPLUS
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