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Details

Stereochemistry ACHIRAL
Molecular Formula C12H12O3S
Molecular Weight 236.287
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3,4-DIMETHYL-1-NAPHTHALENESULFONIC ACID

SMILES

CC1=CC(=C2C=CC=CC2=C1C)S(O)(=O)=O

InChI

InChIKey=TWDSAGQXDOQBFY-UHFFFAOYSA-N
InChI=1S/C12H12O3S/c1-8-7-12(16(13,14)15)11-6-4-3-5-10(11)9(8)2/h3-7H,1-2H3,(H,13,14,15)

HIDE SMILES / InChI

Molecular Formula C12H12O3S
Molecular Weight 236.287
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 10:57:15 GMT 2023
Edited
by admin
on Sat Dec 16 10:57:15 GMT 2023
Record UNII
RJW79BBG5T
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3,4-DIMETHYL-1-NAPHTHALENESULFONIC ACID
Systematic Name English
Code System Code Type Description
CAS
859071-40-2
Created by admin on Sat Dec 16 10:57:15 GMT 2023 , Edited by admin on Sat Dec 16 10:57:15 GMT 2023
PRIMARY
PUBCHEM
89277099
Created by admin on Sat Dec 16 10:57:15 GMT 2023 , Edited by admin on Sat Dec 16 10:57:15 GMT 2023
PRIMARY
FDA UNII
RJW79BBG5T
Created by admin on Sat Dec 16 10:57:15 GMT 2023 , Edited by admin on Sat Dec 16 10:57:15 GMT 2023
PRIMARY
Related Record Type Details
SALT/SOLVATE -> PARENT