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Details

Stereochemistry ACHIRAL
Molecular Formula C16H13ClN4O4S
Molecular Weight 392.817
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of ACID YELLOW 34 FREE ACID

SMILES

CC1=NN(C(O)=C1\N=N\C2=CC=CC=C2)C3=CC(=CC=C3Cl)S(O)(=O)=O

InChI

InChIKey=WNXOIFMOQHEGDP-VHEBQXMUSA-N
InChI=1S/C16H13ClN4O4S/c1-10-15(19-18-11-5-3-2-4-6-11)16(22)21(20-10)14-9-12(26(23,24)25)7-8-13(14)17/h2-9,22H,1H3,(H,23,24,25)/b19-18+

HIDE SMILES / InChI

Molecular Formula C16H13ClN4O4S
Molecular Weight 392.817
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 08:07:29 GMT 2023
Edited
by admin
on Sat Dec 16 08:07:29 GMT 2023
Record UNII
M3V116ZBBD
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ACID YELLOW 34 FREE ACID
Common Name English
BENZENESULFONIC ACID, 4-CHLORO-3-(4,5-DIHYDRO-3-METHYL-5-OXO-4-(2-PHENYLDIAZENYL)-1H-PYRAZOL-1-YL)-
Systematic Name English
4-CHLORO-3-(3-METHYL-5-OXO-4-((E)-PHENYLDIAZENYL)-4,5-DIHYDRO-1H-PYRAZOL-1-YL)BENZENESULFONIC ACID
Systematic Name English
BENZENESULFONIC ACID, 4-CHLORO-3-(4,5-DIHYDRO-3-METHYL-5-OXO-4-(PHENYLAZO)-1H-PYRAZOL-1-YL)-
Systematic Name English
Code System Code Type Description
CAS
748120-95-8
Created by admin on Sat Dec 16 08:07:29 GMT 2023 , Edited by admin on Sat Dec 16 08:07:29 GMT 2023
ALTERNATIVE
CAS
70693-51-5
Created by admin on Sat Dec 16 08:07:29 GMT 2023 , Edited by admin on Sat Dec 16 08:07:29 GMT 2023
PRIMARY
EPA CompTox
DTXSID6047999
Created by admin on Sat Dec 16 08:07:29 GMT 2023 , Edited by admin on Sat Dec 16 08:07:29 GMT 2023
PRIMARY
FDA UNII
M3V116ZBBD
Created by admin on Sat Dec 16 08:07:29 GMT 2023 , Edited by admin on Sat Dec 16 08:07:29 GMT 2023
PRIMARY
CAS
1191102-59-6
Created by admin on Sat Dec 16 08:07:29 GMT 2023 , Edited by admin on Sat Dec 16 08:07:29 GMT 2023
ALTERNATIVE
PUBCHEM
22841
Created by admin on Sat Dec 16 08:07:29 GMT 2023 , Edited by admin on Sat Dec 16 08:07:29 GMT 2023
PRIMARY
Related Record Type Details
SALT/SOLVATE -> PARENT