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

Details

Stereochemistry ACHIRAL
Molecular Formula C5H8O2S2
Molecular Weight 164.246
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1,3-Dithiane-2-carboxylic acid

SMILES

OC(=O)C1SCCCS1

InChI

InChIKey=BZBYEAWKJNCPLB-UHFFFAOYSA-N
InChI=1S/C5H8O2S2/c6-4(7)5-8-2-1-3-9-5/h5H,1-3H2,(H,6,7)

HIDE SMILES / InChI

Approval Year

Name Type Language
1,3-Dithiane-2-carboxylic acid
Systematic Name English
m-Dithiane-2-carboxylic acid
Systematic Name English
NSC-193341
Code English
Code System Code Type Description
CAS
20461-89-6
Created by admin on Sat Dec 16 12:49:07 GMT 2023 , Edited by admin on Sat Dec 16 12:49:07 GMT 2023
PRIMARY
EPA CompTox
DTXSID70174424
Created by admin on Sat Dec 16 12:49:07 GMT 2023 , Edited by admin on Sat Dec 16 12:49:07 GMT 2023
PRIMARY
PUBCHEM
303705
Created by admin on Sat Dec 16 12:49:07 GMT 2023 , Edited by admin on Sat Dec 16 12:49:07 GMT 2023
PRIMARY
FDA UNII
N65QKR49AM
Created by admin on Sat Dec 16 12:49:07 GMT 2023 , Edited by admin on Sat Dec 16 12:49:07 GMT 2023
PRIMARY
NSC
193341
Created by admin on Sat Dec 16 12:49:07 GMT 2023 , Edited by admin on Sat Dec 16 12:49:07 GMT 2023
PRIMARY