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Details

Stereochemistry ACHIRAL
Molecular Formula C3H7O5S3.Na
Molecular Weight 242.269
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Sodium (2-sulfonatoethyl)methanethiosulfonate

SMILES

[Na+].CSS(=O)(=O)CCS([O-])(=O)=O

InChI

InChIKey=ONSHWRYIJNFSRL-UHFFFAOYSA-M
InChI=1S/C3H8O5S3.Na/c1-9-11(7,8)3-2-10(4,5)6;/h2-3H2,1H3,(H,4,5,6);/q;+1/p-1

HIDE SMILES / InChI

Molecular Formula Na
Molecular Weight 22.9898
Charge 1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C3H7O5S3
Molecular Weight 219.28
Charge -1
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 Sat Dec 16 08:21:37 GMT 2023
Edited
by admin
on Sat Dec 16 08:21:37 GMT 2023
Record UNII
J4SU48UKA9
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Sodium (2-sulfonatoethyl)methanethiosulfonate
Systematic Name English
Ethanesulfonic acid, 2-[(methylthio)sulfonyl]-, sodium salt
Common Name English
Ethanesulfonic acid, 2-[(methylthio)sulfonyl]-, methyl ester, sodium salt (1:1)
Common Name English
Code System Code Type Description
FDA UNII
J4SU48UKA9
Created by admin on Sat Dec 16 08:21:37 GMT 2023 , Edited by admin on Sat Dec 16 08:21:37 GMT 2023
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EPA CompTox
DTXSID90935216
Created by admin on Sat Dec 16 08:21:37 GMT 2023 , Edited by admin on Sat Dec 16 08:21:37 GMT 2023
PRIMARY
PUBCHEM
23688468
Created by admin on Sat Dec 16 08:21:37 GMT 2023 , Edited by admin on Sat Dec 16 08:21:37 GMT 2023
PRIMARY
CAS
155450-07-0
Created by admin on Sat Dec 16 08:21:37 GMT 2023 , Edited by admin on Sat Dec 16 08:21:37 GMT 2023
PRIMARY