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

Details

Stereochemistry ACHIRAL
Molecular Formula C13H18O3S
Molecular Weight 254.345
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CYCLOHEXYL P-TOLUENESULFONATE

SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2CCCCC2

InChI

InChIKey=OHHPZPDQZMUTCA-UHFFFAOYSA-N
InChI=1S/C13H18O3S/c1-11-7-9-13(10-8-11)17(14,15)16-12-5-3-2-4-6-12/h7-10,12H,2-6H2,1H3

HIDE SMILES / InChI

Approval Year

Name Type Language
CYCLOHEXYL P-TOLUENESULFONATE
Systematic Name English
NSC-122484
Preferred Name English
BENZENESULFONIC ACID, 4-METHYL-, CYCLOHEXYL ESTER
Systematic Name English
NSC-127370
Code English
Code System Code Type Description
ECHA (EC/EINECS)
213-468-8
Created by admin on Wed Apr 02 13:37:41 GMT 2025 , Edited by admin on Wed Apr 02 13:37:41 GMT 2025
PRIMARY
CAS
953-91-3
Created by admin on Wed Apr 02 13:37:41 GMT 2025 , Edited by admin on Wed Apr 02 13:37:41 GMT 2025
PRIMARY
NSC
122484
Created by admin on Wed Apr 02 13:37:41 GMT 2025 , Edited by admin on Wed Apr 02 13:37:41 GMT 2025
PRIMARY
FDA UNII
X5FBX5NR2A
Created by admin on Wed Apr 02 13:37:41 GMT 2025 , Edited by admin on Wed Apr 02 13:37:41 GMT 2025
PRIMARY
PUBCHEM
13722
Created by admin on Wed Apr 02 13:37:41 GMT 2025 , Edited by admin on Wed Apr 02 13:37:41 GMT 2025
PRIMARY
NSC
127370
Created by admin on Wed Apr 02 13:37:41 GMT 2025 , Edited by admin on Wed Apr 02 13:37:41 GMT 2025
PRIMARY
EPA CompTox
DTXSID3061348
Created by admin on Wed Apr 02 13:37:41 GMT 2025 , Edited by admin on Wed Apr 02 13:37:41 GMT 2025
PRIMARY