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Details

Stereochemistry RACEMIC
Molecular Formula C13H16O4
Molecular Weight 236.2637
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-(2-Formylphenoxy)hexanoic acid

SMILES

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

InChI

InChIKey=BNHZJSWSEINXDJ-UHFFFAOYSA-N
InChI=1S/C13H16O4/c1-2-3-7-12(13(15)16)17-11-8-5-4-6-10(11)9-14/h4-6,8-9,12H,2-3,7H2,1H3,(H,15,16)

HIDE SMILES / InChI

Molecular Formula C13H16O4
Molecular Weight 236.2637
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 20:12:14 GMT 2023
Edited
by admin
on Sat Dec 16 20:12:14 GMT 2023
Record UNII
D2XJK7K3JS
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-(2-Formylphenoxy)hexanoic acid
Systematic Name English
Hexanoic acid, 2-(2-formylphenoxy)-
Systematic Name English
Code System Code Type Description
FDA UNII
D2XJK7K3JS
Created by admin on Sat Dec 16 20:12:14 GMT 2023 , Edited by admin on Sat Dec 16 20:12:14 GMT 2023
PRIMARY
PUBCHEM
17908851
Created by admin on Sat Dec 16 20:12:14 GMT 2023 , Edited by admin on Sat Dec 16 20:12:14 GMT 2023
PRIMARY
CAS
138320-27-1
Created by admin on Sat Dec 16 20:12:14 GMT 2023 , Edited by admin on Sat Dec 16 20:12:14 GMT 2023
PRIMARY