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Details

Stereochemistry ACHIRAL
Molecular Formula C18H24O3S
Molecular Weight 320.446
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4,8-Dibutyl-1-naphthalenesulfonic acid

SMILES

CCCCC1=CC=CC2=C(CCCC)C=CC(=C12)S(O)(=O)=O

InChI

InChIKey=VIHSVCGHKAEXAS-UHFFFAOYSA-N
InChI=1S/C18H24O3S/c1-3-5-8-14-12-13-17(22(19,20)21)18-15(9-6-4-2)10-7-11-16(14)18/h7,10-13H,3-6,8-9H2,1-2H3,(H,19,20,21)

HIDE SMILES / InChI

Molecular Formula C18H24O3S
Molecular Weight 320.446
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 Wed Apr 02 18:42:37 GMT 2025
Edited
by admin
on Wed Apr 02 18:42:37 GMT 2025
Record UNII
LRN2XZ3RMD
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1-Naphthalenesulfonic acid, 4,8-dibutyl-
Preferred Name English
4,8-Dibutyl-1-naphthalenesulfonic acid
Systematic Name English
Code System Code Type Description
CAS
68519-98-2
Created by admin on Wed Apr 02 18:42:37 GMT 2025 , Edited by admin on Wed Apr 02 18:42:37 GMT 2025
PRIMARY
PUBCHEM
71439806
Created by admin on Wed Apr 02 18:42:37 GMT 2025 , Edited by admin on Wed Apr 02 18:42:37 GMT 2025
PRIMARY
FDA UNII
LRN2XZ3RMD
Created by admin on Wed Apr 02 18:42:37 GMT 2025 , Edited by admin on Wed Apr 02 18:42:37 GMT 2025
PRIMARY
Related Record Type Details
SALT/SOLVATE -> PARENT