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

Details

Stereochemistry ACHIRAL
Molecular Formula C6H5F9S
Molecular Weight 280.155
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-(PERFLUOROBUTYL)ETHANETHIOL

SMILES

FC(F)(F)C(F)(F)C(F)(F)C(F)(F)CCS

InChI

InChIKey=GQJXVHYUQPXZOL-UHFFFAOYSA-N
InChI=1S/C6H5F9S/c7-3(8,1-2-16)4(9,10)5(11,12)6(13,14)15/h16H,1-2H2

HIDE SMILES / InChI

Approval Year

Name Type Language
2-(PERFLUOROBUTYL)ETHANETHIOL
Systematic Name English
1-HEXANETHIOL, 3,3,4,4,5,5,6,6,6-NONAFLUORO-
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID40880388
Created by admin on Fri Dec 15 17:47:31 GMT 2023 , Edited by admin on Fri Dec 15 17:47:31 GMT 2023
PRIMARY
PUBCHEM
109607
Created by admin on Fri Dec 15 17:47:31 GMT 2023 , Edited by admin on Fri Dec 15 17:47:31 GMT 2023
PRIMARY
FDA UNII
Z3A52935OO
Created by admin on Fri Dec 15 17:47:31 GMT 2023 , Edited by admin on Fri Dec 15 17:47:31 GMT 2023
PRIMARY
CAS
34451-25-7
Created by admin on Fri Dec 15 17:47:31 GMT 2023 , Edited by admin on Fri Dec 15 17:47:31 GMT 2023
PRIMARY