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Details

Stereochemistry ACHIRAL
Molecular Formula C13H18O3
Molecular Weight 222.2802
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of HEXYL SALICYLATE

SMILES

CCCCCCOC(=O)C1=C(O)C=CC=C1

InChI

InChIKey=DUKPKQFHJQGTGU-UHFFFAOYSA-N
InChI=1S/C13H18O3/c1-2-3-4-7-10-16-13(15)11-8-5-6-9-12(11)14/h5-6,8-9,14H,2-4,7,10H2,1H3

HIDE SMILES / InChI

Molecular Formula C13H18O3
Molecular Weight 222.2802
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
Prediction of estrogen receptor agonists and characterization of associated molecular descriptors by statistical learning methods.
2006 Nov
Effective and efficient photoluminescence of salicylate-ligating terbium(III) clusters stabilized by multiple phenyl-phenyl interactions.
2007 Mar 28
Substance Class Chemical
Created
by admin
on Fri Dec 15 19:15:40 GMT 2023
Edited
by admin
on Fri Dec 15 19:15:40 GMT 2023
Record UNII
8F78EY72YL
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
HEXYL SALICYLATE
INCI  
INCI  
Official Name English
HEXYL SALICYLATE [INCI]
Common Name English
N-HEXYL SALICYLATE
Common Name English
SALICYL ACID, N-HEXYL ESTER
Common Name English
1-HEXYL SALICYLATE
Systematic Name English
BENZOIC ACID, 2-HYDROXY-, HEXYL ESTER
Common Name English
Code System Code Type Description
FDA UNII
8F78EY72YL
Created by admin on Fri Dec 15 19:15:40 GMT 2023 , Edited by admin on Fri Dec 15 19:15:40 GMT 2023
PRIMARY
EPA CompTox
DTXSID4038924
Created by admin on Fri Dec 15 19:15:40 GMT 2023 , Edited by admin on Fri Dec 15 19:15:40 GMT 2023
PRIMARY
MESH
C526485
Created by admin on Fri Dec 15 19:15:40 GMT 2023 , Edited by admin on Fri Dec 15 19:15:40 GMT 2023
PRIMARY
DAILYMED
8F78EY72YL
Created by admin on Fri Dec 15 19:15:40 GMT 2023 , Edited by admin on Fri Dec 15 19:15:40 GMT 2023
PRIMARY
CAS
6259-76-3
Created by admin on Fri Dec 15 19:15:40 GMT 2023 , Edited by admin on Fri Dec 15 19:15:40 GMT 2023
PRIMARY
ECHA (EC/EINECS)
228-408-6
Created by admin on Fri Dec 15 19:15:40 GMT 2023 , Edited by admin on Fri Dec 15 19:15:40 GMT 2023
PRIMARY
PUBCHEM
22629
Created by admin on Fri Dec 15 19:15:40 GMT 2023 , Edited by admin on Fri Dec 15 19:15:40 GMT 2023
PRIMARY
RXCUI
1421892
Created by admin on Fri Dec 15 19:15:40 GMT 2023 , Edited by admin on Fri Dec 15 19:15:40 GMT 2023
PRIMARY RxNorm