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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 DIISOBUTYLNAPHTHALENE-1-SULFONIC ACID

SMILES

CC(C)CC1=C(CC(C)C)C(=C2C=CC=CC2=C1)S(O)(=O)=O

InChI

InChIKey=KBLAMUYRMZPYLS-UHFFFAOYSA-N
InChI=1S/C18H24O3S/c1-12(2)9-15-11-14-7-5-6-8-16(14)18(22(19,20)21)17(15)10-13(3)4/h5-8,11-13H,9-10H2,1-4H3,(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 Sat Dec 16 12:25:36 GMT 2023
Edited
by admin
on Sat Dec 16 12:25:36 GMT 2023
Record UNII
BDS6NB5UM5
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DIISOBUTYLNAPHTHALENE-1-SULFONIC ACID
Systematic Name English
2,3-BIS(2-METHYLPROPYL)-1-NAPHTHALENESULFONIC ACID
Systematic Name English
1-NAPHTHALENESULFONIC ACID, 2,3-BIS(2-METHYLPROPYL)-
Systematic Name English
Code System Code Type Description
PUBCHEM
3015459
Created by admin on Sat Dec 16 12:25:36 GMT 2023 , Edited by admin on Sat Dec 16 12:25:36 GMT 2023
PRIMARY
FDA UNII
BDS6NB5UM5
Created by admin on Sat Dec 16 12:25:36 GMT 2023 , Edited by admin on Sat Dec 16 12:25:36 GMT 2023
PRIMARY
ECHA (EC/EINECS)
304-244-1
Created by admin on Sat Dec 16 12:25:36 GMT 2023 , Edited by admin on Sat Dec 16 12:25:36 GMT 2023
PRIMARY
CAS
94247-74-2
Created by admin on Sat Dec 16 12:25:36 GMT 2023 , Edited by admin on Sat Dec 16 12:25:36 GMT 2023
ALTERNATIVE
EPA CompTox
DTXSID30241267
Created by admin on Sat Dec 16 12:25:36 GMT 2023 , Edited by admin on Sat Dec 16 12:25:36 GMT 2023
PRIMARY
CAS
958791-65-6
Created by admin on Sat Dec 16 12:25:36 GMT 2023 , Edited by admin on Sat Dec 16 12:25:36 GMT 2023
PRIMARY