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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

Molecular Formula C9H18O3
Molecular Weight 174.2374
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 10:19:38 GMT 2023
Edited
by admin
on Sat Dec 16 10:19:38 GMT 2023
Record UNII
0430E63824
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
METHYL 2-ETHYL-6-HYDROXYHEXANOATE
Systematic Name English
HEXANOIC ACID, 2-ETHYL-6-HYDROXY-, METHYL ESTER
Systematic Name English
Code System Code Type Description
CAS
86476-39-3
Created by admin on Sat Dec 16 10:19:38 GMT 2023 , Edited by admin on Sat Dec 16 10:19:38 GMT 2023
PRIMARY
PUBCHEM
119057990
Created by admin on Sat Dec 16 10:19:38 GMT 2023 , Edited by admin on Sat Dec 16 10:19:38 GMT 2023
PRIMARY
FDA UNII
0430E63824
Created by admin on Sat Dec 16 10:19:38 GMT 2023 , Edited by admin on Sat Dec 16 10:19:38 GMT 2023
PRIMARY