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Details

Stereochemistry ACHIRAL
Molecular Formula C6H14OS
Molecular Weight 134.24
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-(tert-Butylthio)ethanol

SMILES

CC(C)(C)SCCO

InChI

InChIKey=INULQKSPBVGHOU-UHFFFAOYSA-N
InChI=1S/C6H14OS/c1-6(2,3)8-5-4-7/h7H,4-5H2,1-3H3

HIDE SMILES / InChI

Molecular Formula C6H14OS
Molecular Weight 134.24
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Tue Apr 01 17:11:56 GMT 2025
Edited
by admin
on Tue Apr 01 17:11:56 GMT 2025
Record UNII
626G7CM9HP
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NSC-2241
Preferred Name English
2-(tert-Butylthio)ethanol
Systematic Name English
2-tert-Butylsulfanylethanol
Systematic Name English
Ethanol, 2-(tert-butylthio)-
Systematic Name English
Ethanol, 2-[(1,1-dimethylethyl)thio]-
Systematic Name English
2-[(1,1-Dimethylethyl)thio]ethanol
Systematic Name English
2-(tert-Butylsulfanyl)ethan-1-ol
Systematic Name English
Code System Code Type Description
FDA UNII
626G7CM9HP
Created by admin on Tue Apr 01 17:11:56 GMT 2025 , Edited by admin on Tue Apr 01 17:11:56 GMT 2025
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EPA CompTox
DTXSID00202249
Created by admin on Tue Apr 01 17:11:56 GMT 2025 , Edited by admin on Tue Apr 01 17:11:56 GMT 2025
PRIMARY
CAS
5396-50-9
Created by admin on Tue Apr 01 17:11:56 GMT 2025 , Edited by admin on Tue Apr 01 17:11:56 GMT 2025
PRIMARY
ECHA (EC/EINECS)
226-413-8
Created by admin on Tue Apr 01 17:11:56 GMT 2025 , Edited by admin on Tue Apr 01 17:11:56 GMT 2025
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PUBCHEM
79379
Created by admin on Tue Apr 01 17:11:56 GMT 2025 , Edited by admin on Tue Apr 01 17:11:56 GMT 2025
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NSC
2241
Created by admin on Tue Apr 01 17:11:56 GMT 2025 , Edited by admin on Tue Apr 01 17:11:56 GMT 2025
PRIMARY