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Details

Stereochemistry MIXED
Molecular Formula C17H36O4S
Molecular Weight 336.53
Optical Activity UNSPECIFIED
Defined Stereocenters 0 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-ETHYL-1-(3-ETHYLPENTYL)-1-OCTYL SULFATE

SMILES

CCCCC(CC)CCC(CCC(CC)CC)OS(O)(=O)=O

InChI

InChIKey=MSYSDQBIFATOQW-UHFFFAOYSA-N
InChI=1S/C17H36O4S/c1-5-9-10-16(8-4)12-14-17(21-22(18,19)20)13-11-15(6-2)7-3/h15-17H,5-14H2,1-4H3,(H,18,19,20)

HIDE SMILES / InChI

Approval Year

Unknown
149124
Name Type Language
3,9-DIETHYL-6-TRIDECYL HYDROGEN SULFATE
Preferred Name English
4-ETHYL-1-(3-ETHYLPENTYL)-1-OCTYL SULFATE
Systematic Name English
6-TRIDECANOL, 3,9-DIETHYL-, HYDROGEN SULFATE
Systematic Name English
6-TRIDECANOL, 3,9-DIETHYL-, 6-(HYDROGEN SULFATE)
Systematic Name English
Code System Code Type Description
PUBCHEM
11348297
Created by admin on Mon Mar 31 23:45:43 GMT 2025 , Edited by admin on Mon Mar 31 23:45:43 GMT 2025
PRIMARY
FDA UNII
24WR5Z3L9U
Created by admin on Mon Mar 31 23:45:43 GMT 2025 , Edited by admin on Mon Mar 31 23:45:43 GMT 2025
PRIMARY
CAS
141-71-9
Created by admin on Mon Mar 31 23:45:43 GMT 2025 , Edited by admin on Mon Mar 31 23:45:43 GMT 2025
PRIMARY
NIH
NCATS
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