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Details

Stereochemistry ACHIRAL
Molecular Formula C8H14O2S
Molecular Weight 174.261
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4,4'-THIOBIS-2-BUTANONE

SMILES

CC(=O)CCSCCC(C)=O

InChI

InChIKey=CIBUHUTVSRPCRO-UHFFFAOYSA-N
InChI=1S/C8H14O2S/c1-7(9)3-5-11-6-4-8(2)10/h3-6H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C8H14O2S
Molecular Weight 174.261
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Patents

Patents

Substance Class Chemical
Created
by admin
on Fri Dec 15 18:32:30 GMT 2023
Edited
by admin
on Fri Dec 15 18:32:30 GMT 2023
Record UNII
YYI4W02CLD
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4,4'-THIOBIS-2-BUTANONE
Systematic Name English
4,4'-THIOBIS(2-BUTANONE)
Systematic Name English
4,4'-THIODI(2-BUTANONE)
Systematic Name English
2-BUTANONE, 4,4'-THIOBIS-
Systematic Name English
DI(BUTAN-3-ONE-1-YL) SULFIDE [FHFI]
Common Name English
NSC-42865
Code English
4.4'-THIOBIS-2-BUTANONE
Common Name English
FEMA NO. 3335
Code English
DI-(BUTAN-3-ONE-1-YL) SULFIDE
Common Name English
DI(BUTAN-3-ONE-1-YL) SULFIDE
FHFI  
Common Name English
2-BUTANONE, 4,4'-THIODI-
Systematic Name English
5-THIANONA-2,8-DIONE
Common Name English
Classification Tree Code System Code
JECFA EVALUATION DI(BUTAN-3-ONE-1-YL) SULFIDE
Created by admin on Fri Dec 15 18:32:30 GMT 2023 , Edited by admin on Fri Dec 15 18:32:30 GMT 2023
Code System Code Type Description
CAS
40790-04-3
Created by admin on Fri Dec 15 18:32:30 GMT 2023 , Edited by admin on Fri Dec 15 18:32:30 GMT 2023
PRIMARY
JECFA MONOGRAPH
120
Created by admin on Fri Dec 15 18:32:30 GMT 2023 , Edited by admin on Fri Dec 15 18:32:30 GMT 2023
PRIMARY
EPA CompTox
DTXSID8068254
Created by admin on Fri Dec 15 18:32:30 GMT 2023 , Edited by admin on Fri Dec 15 18:32:30 GMT 2023
PRIMARY
PUBCHEM
61989
Created by admin on Fri Dec 15 18:32:30 GMT 2023 , Edited by admin on Fri Dec 15 18:32:30 GMT 2023
PRIMARY
NSC
42865
Created by admin on Fri Dec 15 18:32:30 GMT 2023 , Edited by admin on Fri Dec 15 18:32:30 GMT 2023
PRIMARY
FDA UNII
YYI4W02CLD
Created by admin on Fri Dec 15 18:32:30 GMT 2023 , Edited by admin on Fri Dec 15 18:32:30 GMT 2023
PRIMARY