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Details

Stereochemistry ACHIRAL
Molecular Formula C12H22O4S2
Molecular Weight 294.431
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Dibutyl 2,2'-dithiodiacetate

SMILES

CCCCOC(=O)CSSCC(=O)OCCCC

InChI

InChIKey=RUKRYLBUAIGWQI-UHFFFAOYSA-N
InChI=1S/C12H22O4S2/c1-3-5-7-15-11(13)9-17-18-10-12(14)16-8-6-4-2/h3-10H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C12H22O4S2
Molecular Weight 294.431
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 17:48:09 GMT 2025
Edited
by admin
on Tue Apr 01 17:48:09 GMT 2025
Record UNII
X2MM4WR3KL
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Dibutyl 2,2'-dithiodiacetate
Systematic Name English
NSC-163305
Preferred Name English
Acetic acid, 2,2?-dithiobis-, 1,1?-dibutyl ester
Systematic Name English
1,1?-Dibutyl 2,2?-dithiobis[acetate]
Systematic Name English
Code System Code Type Description
NSC
163305
Created by admin on Tue Apr 01 17:48:10 GMT 2025 , Edited by admin on Tue Apr 01 17:48:10 GMT 2025
PRIMARY
FDA UNII
X2MM4WR3KL
Created by admin on Tue Apr 01 17:48:10 GMT 2025 , Edited by admin on Tue Apr 01 17:48:10 GMT 2025
PRIMARY
EPA CompTox
DTXSID70178669
Created by admin on Tue Apr 01 17:48:10 GMT 2025 , Edited by admin on Tue Apr 01 17:48:10 GMT 2025
PRIMARY
PUBCHEM
90308
Created by admin on Tue Apr 01 17:48:10 GMT 2025 , Edited by admin on Tue Apr 01 17:48:10 GMT 2025
PRIMARY
CAS
23959-95-7
Created by admin on Tue Apr 01 17:48:10 GMT 2025 , Edited by admin on Tue Apr 01 17:48:10 GMT 2025
PRIMARY
ECHA (EC/EINECS)
245-954-0
Created by admin on Tue Apr 01 17:48:10 GMT 2025 , Edited by admin on Tue Apr 01 17:48:10 GMT 2025
PRIMARY