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Details

Stereochemistry RACEMIC
Molecular Formula C9H18O3
Molecular Weight 174.2374
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of METHYL 2-ETHYL-6-HYDROXYHEXANOATE

SMILES

CCC(CCCCO)C(=O)OC

InChI

InChIKey=VJQRLTGXOZNUAX-UHFFFAOYSA-N
InChI=1S/C9H18O3/c1-3-8(9(11)12-2)6-4-5-7-10/h8,10H,3-7H2,1-2H3

HIDE SMILES / InChI

Approval Year

Unknown
149124
Name Type Language
HEXANOIC ACID, 2-ETHYL-6-HYDROXY-, METHYL ESTER
Preferred Name English
METHYL 2-ETHYL-6-HYDROXYHEXANOATE
Systematic Name English
Code System Code Type Description
CAS
86476-39-3
Created by admin on Mon Mar 31 23:10:41 GMT 2025 , Edited by admin on Mon Mar 31 23:10:41 GMT 2025
PRIMARY
PUBCHEM
119057990
Created by admin on Mon Mar 31 23:10:41 GMT 2025 , Edited by admin on Mon Mar 31 23:10:41 GMT 2025
PRIMARY
FDA UNII
0430E63824
Created by admin on Mon Mar 31 23:10:41 GMT 2025 , Edited by admin on Mon Mar 31 23:10:41 GMT 2025
PRIMARY
NIH
NCATS
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