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

Details

Stereochemistry ACHIRAL
Molecular Formula C7H12S2
Molecular Weight 160.3
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CYCLOPENTANONE ETHYLENE DITHIOKETAL

SMILES

C1CCC2(C1)SCCS2

InChI

InChIKey=PQILQFSSQOQLEJ-UHFFFAOYSA-N
InChI=1S/C7H12S2/c1-2-4-7(3-1)8-5-6-9-7/h1-6H2

HIDE SMILES / InChI

Molecular Formula C7H12S2
Molecular Weight 160.3
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 Fri Dec 15 17:52:17 GMT 2023
Edited
by admin
on Fri Dec 15 17:52:17 GMT 2023
Record UNII
702C814QVJ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CYCLOPENTANONE ETHYLENE DITHIOKETAL
Systematic Name English
CYCLOPENTANONE ETHYLENE DITHIOACETAL
Systematic Name English
1,4-DITHIASPIRO(4.4)NONANE
Systematic Name English
Code System Code Type Description
CAS
176-39-6
Created by admin on Fri Dec 15 17:52:17 GMT 2023 , Edited by admin on Fri Dec 15 17:52:17 GMT 2023
PRIMARY
EPA CompTox
DTXSID80170058
Created by admin on Fri Dec 15 17:52:17 GMT 2023 , Edited by admin on Fri Dec 15 17:52:17 GMT 2023
PRIMARY
PUBCHEM
9090
Created by admin on Fri Dec 15 17:52:17 GMT 2023 , Edited by admin on Fri Dec 15 17:52:17 GMT 2023
PRIMARY
FDA UNII
702C814QVJ
Created by admin on Fri Dec 15 17:52:17 GMT 2023 , Edited by admin on Fri Dec 15 17:52:17 GMT 2023
PRIMARY