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Details

Stereochemistry ACHIRAL
Molecular Formula C6H15NS2.ClH
Molecular Weight 201.781
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-(tert-Butyldithio)ethylamine hydrochloride

SMILES

Cl.CC(C)(C)SSCCN

InChI

InChIKey=BKRREUFABWFQRH-UHFFFAOYSA-N
InChI=1S/C6H15NS2.ClH/c1-6(2,3)9-8-5-4-7;/h4-5,7H2,1-3H3;1H

HIDE SMILES / InChI
Molecular Formula C6H15NS2
Molecular Weight 165.32
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE
Molecular Formula ClH
Molecular Weight 36.461
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Unknown
149124
Substance Class Chemical
Created
by admin
on Wed Apr 02 15:58:43 GMT 2025
Edited
by admin
on Wed Apr 02 15:58:43 GMT 2025
Record UNII
T6U9ZU4C8J
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NSC-342024
Preferred Name English
2-(tert-Butyldithio)ethylamine hydrochloride
Systematic Name English
Ethanamine, 2-[(1,1-dimethylethyl)dithio]-, hydrochloride
Systematic Name English
Ethanamine, 2-[(1,1-dimethylethyl)dithio]-, hydrochloride (1:1)
Systematic Name English
Ethylamine, 2-(tert-butyldithio)-, hydrochloride
Systematic Name English
Code System Code Type Description
NSC
342024
Created by admin on Wed Apr 02 15:58:43 GMT 2025 , Edited by admin on Wed Apr 02 15:58:43 GMT 2025
PRIMARY
CAS
69311-58-6
Created by admin on Wed Apr 02 15:58:43 GMT 2025 , Edited by admin on Wed Apr 02 15:58:43 GMT 2025
PRIMARY
PUBCHEM
14334728
Created by admin on Wed Apr 02 15:58:43 GMT 2025 , Edited by admin on Wed Apr 02 15:58:43 GMT 2025
PRIMARY
FDA UNII
T6U9ZU4C8J
Created by admin on Wed Apr 02 15:58:43 GMT 2025 , Edited by admin on Wed Apr 02 15:58:43 GMT 2025
PRIMARY
EPA CompTox
DTXSID40219371
Created by admin on Wed Apr 02 15:58:43 GMT 2025 , Edited by admin on Wed Apr 02 15:58:43 GMT 2025
PRIMARY
Related Record Type Details
Structure of 2-tert-butyldisulfanylethanamine
PARENT -> SALT/SOLVATE
NIH
NCATS
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