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Details

Stereochemistry ACHIRAL
Molecular Formula C9H11O3S.Na
Molecular Weight 222.237
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of SODIUM M-CUMENESULFONATE

SMILES

[Na+].CC(C)C1=CC=CC(=C1)S([O-])(=O)=O

InChI

InChIKey=AOHCANAFQBWHJE-UHFFFAOYSA-M
InChI=1S/C9H12O3S.Na/c1-7(2)8-4-3-5-9(6-8)13(10,11)12;/h3-7H,1-2H3,(H,10,11,12);/q;+1/p-1

HIDE SMILES / InChI

Molecular Formula C9H11O3S
Molecular Weight 199.247
Charge -1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

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

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 19:09:52 GMT 2023
Edited
by admin
on Fri Dec 15 19:09:52 GMT 2023
Record UNII
1FL59E3M9R
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
SODIUM M-CUMENESULFONATE
Systematic Name English
M-CUMENESULFONIC ACID, SODIUM SALT
Common Name English
SODIUM 3-ISOPROPYLBENZENESULFONATE
Systematic Name English
SODIUM M-CUMENESULPHONATE
Systematic Name English
M-CUMENESULPHONIC ACID, SODIUM SALT
Common Name English
SODIUM 3-ISOPROPYLBENZENESULPHONATE
Systematic Name English
BENZENESULFONIC ACID, 3-(1-METHYLETHYL)-, SODIUM SALT (1:1)
Common Name English
Code System Code Type Description
PUBCHEM
23687323
Created by admin on Fri Dec 15 19:09:52 GMT 2023 , Edited by admin on Fri Dec 15 19:09:52 GMT 2023
PRIMARY
EPA CompTox
DTXSID70872317
Created by admin on Fri Dec 15 19:09:52 GMT 2023 , Edited by admin on Fri Dec 15 19:09:52 GMT 2023
PRIMARY
FDA UNII
1FL59E3M9R
Created by admin on Fri Dec 15 19:09:52 GMT 2023 , Edited by admin on Fri Dec 15 19:09:52 GMT 2023
PRIMARY
CAS
65130-69-0
Created by admin on Fri Dec 15 19:09:52 GMT 2023 , Edited by admin on Fri Dec 15 19:09:52 GMT 2023
PRIMARY