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

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

Approval Year

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
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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
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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
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