U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry RACEMIC
Molecular Formula C14H18O4
Molecular Weight 250.2903
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Methyl 2-(2-formylphenoxy)hexanoate

SMILES

CCCCC(OC1=C(C=O)C=CC=C1)C(=O)OC

InChI

InChIKey=HMXPIWQSUXBNFU-UHFFFAOYSA-N
InChI=1S/C14H18O4/c1-3-4-8-13(14(16)17-2)18-12-9-6-5-7-11(12)10-15/h5-7,9-10,13H,3-4,8H2,1-2H3

HIDE SMILES / InChI

Approval Year

Name Type Language
Methyl 2-(2-formylphenoxy)hexanoate
Systematic Name English
Methyl 2-(2′-formylphenoxy)caproate
Systematic Name English
Code System Code Type Description
FDA UNII
8JST4TZQ53
Created by admin on Sat Dec 16 19:57:47 GMT 2023 , Edited by admin on Sat Dec 16 19:57:47 GMT 2023
PRIMARY
CAS
138320-26-0
Created by admin on Sat Dec 16 19:57:47 GMT 2023 , Edited by admin on Sat Dec 16 19:57:47 GMT 2023
PRIMARY
PUBCHEM
11448076
Created by admin on Sat Dec 16 19:57:47 GMT 2023 , Edited by admin on Sat Dec 16 19:57:47 GMT 2023
PRIMARY