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Details

Stereochemistry ACHIRAL
Molecular Formula C10H20O5S
Molecular Weight 252.328
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CAPRYLOYL ISETHIONIC ACID

SMILES

CCCCCCCC(=O)OCCS(O)(=O)=O

InChI

InChIKey=ZWDUZVBUHJVJNB-UHFFFAOYSA-N
InChI=1S/C10H20O5S/c1-2-3-4-5-6-7-10(11)15-8-9-16(12,13)14/h2-9H2,1H3,(H,12,13,14)

HIDE SMILES / InChI

Molecular Formula C10H20O5S
Molecular Weight 252.328
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 Sat Dec 16 18:56:52 GMT 2023
Edited
by admin
on Sat Dec 16 18:56:52 GMT 2023
Record UNII
DA4DSU53DB
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CAPRYLOYL ISETHIONIC ACID
Common Name English
OCTANOIC ACID, 2-SULFOETHYL ESTER
Systematic Name English
OCTANOIC ACID 2-SULFOETHYL ESTER
Systematic Name English
CAPRYLOYL ISETHIONATE
Common Name English
2-SULFOETHYL OCTANOATE
Systematic Name English
Code System Code Type Description
CAS
56022-51-6
Created by admin on Sat Dec 16 18:56:53 GMT 2023 , Edited by admin on Sat Dec 16 18:56:53 GMT 2023
PRIMARY
FDA UNII
DA4DSU53DB
Created by admin on Sat Dec 16 18:56:53 GMT 2023 , Edited by admin on Sat Dec 16 18:56:53 GMT 2023
PRIMARY
PUBCHEM
20455403
Created by admin on Sat Dec 16 18:56:53 GMT 2023 , Edited by admin on Sat Dec 16 18:56:53 GMT 2023
PRIMARY
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