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Details

Stereochemistry RACEMIC
Molecular Formula C9H16O4
Molecular Weight 188.2209
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of METHYL 5-ACETOXYHEXANOATE

SMILES

COC(=O)CCCC(C)OC(C)=O

InChI

InChIKey=XZGQJRXRXRYNRI-UHFFFAOYSA-N
InChI=1S/C9H16O4/c1-7(13-8(2)10)5-4-6-9(11)12-3/h7H,4-6H2,1-3H3

HIDE SMILES / InChI

Approval Year

Name Type Language
METHYL 5-ACETOXYHEXANOATE
Systematic Name English
(±)-METHYL 5-ACETOXYHEXANOATE
FHFI  
Systematic Name English
.DELTA.-ACETOXYCAPROIC ACID METHYL ESTER
Systematic Name English
HEXANOIC ACID, 5-(ACETYLOXY)-, METHYL ESTER
Common Name English
FEMA NO. 4055
Code English
(±)-METHYL 5-ACETOXYHEXANOATE [FHFI]
Common Name English
Classification Tree Code System Code
JECFA EVALUATION METHYL 5-ACETOXYHEXANOATE
Created by admin on Fri Dec 15 20:39:48 UTC 2023 , Edited by admin on Fri Dec 15 20:39:48 UTC 2023
Code System Code Type Description
EPA CompTox
DTXSID00956674
Created by admin on Fri Dec 15 20:39:48 UTC 2023 , Edited by admin on Fri Dec 15 20:39:48 UTC 2023
PRIMARY
FDA UNII
9EO0I65AAO
Created by admin on Fri Dec 15 20:39:48 UTC 2023 , Edited by admin on Fri Dec 15 20:39:48 UTC 2023
PRIMARY
JECFA MONOGRAPH
1703
Created by admin on Fri Dec 15 20:39:48 UTC 2023 , Edited by admin on Fri Dec 15 20:39:48 UTC 2023
PRIMARY
CAS
35234-22-1
Created by admin on Fri Dec 15 20:39:48 UTC 2023 , Edited by admin on Fri Dec 15 20:39:48 UTC 2023
PRIMARY
PUBCHEM
526152
Created by admin on Fri Dec 15 20:39:48 UTC 2023 , Edited by admin on Fri Dec 15 20:39:48 UTC 2023
PRIMARY