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

Details

Stereochemistry MIXED
Molecular Formula C8H18S2
Molecular Weight 178.359
Optical Activity UNSPECIFIED
Defined Stereocenters 0 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DI-SEC-BUTYL DISULFIDE

SMILES

CCC(C)SSC(C)CC

InChI

InChIKey=QTWKINKGAHTPFJ-UHFFFAOYSA-N
InChI=1S/C8H18S2/c1-5-7(3)9-10-8(4)6-2/h7-8H,5-6H2,1-4H3

HIDE SMILES / InChI

Molecular Formula C8H18S2
Molecular Weight 178.359
Charge 0
Count
Stereochemistry MIXED
Additional Stereochemistry No
Defined Stereocenters 0 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

PubMed

PubMed

TitleDatePubMed
Rhodium-catalyzed disulfide exchange reaction.
2003 Jun 4
Substance Class Chemical
Created
by admin
on Sat Dec 16 00:09:52 GMT 2023
Edited
by admin
on Sat Dec 16 00:09:52 GMT 2023
Record UNII
P593TCY71H
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DI-SEC-BUTYL DISULFIDE
Systematic Name English
BIS(1-METHYLPROPYL) DISULFIDE
Systematic Name English
SEC-BUTYL DISULFIDE
Systematic Name English
1-METHYLPROPYL DISULFIDE
Systematic Name English
DISULFIDE, BIS(1-METHYLPROPYL)
Systematic Name English
DIBUTAN-2-YL DISULFIDE
Systematic Name English
DI(1-METHYLPROPYL) DISULFIDE
Systematic Name English
FEMA NO. 4578
Code English
3,6-DIMETHYL-4,5-DITHIAOCTANE
Systematic Name English
BIS(2-BUTYL) DISULFIDE
Systematic Name English
Classification Tree Code System Code
JECFA EVALUATION DI-SEC-BUTYL DISULFIDE
Created by admin on Sat Dec 16 00:09:52 GMT 2023 , Edited by admin on Sat Dec 16 00:09:52 GMT 2023
Code System Code Type Description
PUBCHEM
94314
Created by admin on Sat Dec 16 00:09:52 GMT 2023 , Edited by admin on Sat Dec 16 00:09:52 GMT 2023
PRIMARY
EPA CompTox
DTXSID6044698
Created by admin on Sat Dec 16 00:09:52 GMT 2023 , Edited by admin on Sat Dec 16 00:09:52 GMT 2023
PRIMARY
CAS
5943-30-6
Created by admin on Sat Dec 16 00:09:52 GMT 2023 , Edited by admin on Sat Dec 16 00:09:52 GMT 2023
PRIMARY
JECFA MONOGRAPH
1911
Created by admin on Sat Dec 16 00:09:52 GMT 2023 , Edited by admin on Sat Dec 16 00:09:52 GMT 2023
PRIMARY
FDA UNII
P593TCY71H
Created by admin on Sat Dec 16 00:09:52 GMT 2023 , Edited by admin on Sat Dec 16 00:09:52 GMT 2023
PRIMARY
ECHA (EC/EINECS)
227-702-1
Created by admin on Sat Dec 16 00:09:52 GMT 2023 , Edited by admin on Sat Dec 16 00:09:52 GMT 2023
PRIMARY