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Details

Stereochemistry RACEMIC
Molecular Formula C11H23O5S.Na
Molecular Weight 290.352
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of SODIUM CAPRYLYL PG-SULFONATE

SMILES

[Na+].CCCCCCCCOCC(O)CS([O-])(=O)=O

InChI

InChIKey=UXJCQISMJSCAOK-UHFFFAOYSA-M
InChI=1S/C11H24O5S.Na/c1-2-3-4-5-6-7-8-16-9-11(12)10-17(13,14)15;/h11-12H,2-10H2,1H3,(H,13,14,15);/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 C11H23O5S
Molecular Weight 267.362
Charge -1
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 01:46:22 GMT 2023
Edited
by admin
on Sat Dec 16 01:46:22 GMT 2023
Record UNII
AP6892L90I
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
SODIUM CAPRYLYL PG-SULFONATE
INCI  
INCI  
Official Name English
1-PROPANESULFONIC ACID, 2-HYDROXY-3-(OCTYLOXY)-, SODIUM SALT (1:1)
Common Name English
1-PROPANESULFONIC ACID, 2-HYDROXY-3-(OCTYLOXY)-, SODIUM SALT
Common Name English
SODIUM 2-HYDROXY-3-OCTYLOXYPROPYLSULFONATE
Systematic Name English
1-PROPANESULFONIC ACID, 2-HYDROXY-3-(OCTYLOXY)-, MONOSODIUM SALT
Common Name English
AGS-898
Brand Name English
SODIUM 2-HYDROXY-3-OCTYLOXY-1-PROPANESULFONATE
Systematic Name English
SODIUM CAPRYLYL PG-SULFONATE [INCI]
Common Name English
Code System Code Type Description
FDA UNII
AP6892L90I
Created by admin on Sat Dec 16 01:46:22 GMT 2023 , Edited by admin on Sat Dec 16 01:46:22 GMT 2023
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CAS
51946-14-6
Created by admin on Sat Dec 16 01:46:22 GMT 2023 , Edited by admin on Sat Dec 16 01:46:22 GMT 2023
PRIMARY
EPA CompTox
DTXSID20885977
Created by admin on Sat Dec 16 01:46:22 GMT 2023 , Edited by admin on Sat Dec 16 01:46:22 GMT 2023
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PUBCHEM
23695318
Created by admin on Sat Dec 16 01:46:22 GMT 2023 , Edited by admin on Sat Dec 16 01:46:22 GMT 2023
PRIMARY