U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C16H14N4O4S
Molecular Weight 358.372
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of ACID YELLOW 11 FREE ACID

SMILES

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

InChI

InChIKey=XYRJCVNSUGQSQU-ISLYRVAYSA-N
InChI=1S/C16H14N4O4S/c1-11-15(18-17-12-5-3-2-4-6-12)16(21)20(19-11)13-7-9-14(10-8-13)25(22,23)24/h2-10,21H,1H3,(H,22,23,24)/b18-17+

HIDE SMILES / InChI

Molecular Formula C16H14N4O4S
Molecular Weight 358.372
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 08:12:00 GMT 2023
Edited
by admin
on Sat Dec 16 08:12:00 GMT 2023
Record UNII
Z3CN6SP8WS
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ACID YELLOW 11 FREE ACID
Common Name English
CI ACID YELLOW 11
Common Name English
BENZENESULFONIC ACID, 4-(4,5-DIHYDRO-3-METHYL-5-OXO-4-((1E)-2-PHENYLDIAZENYL)-1H-PYRAZOL-1-YL)-
Systematic Name English
BENZENESULFONIC ACID, 4-(5-HYDROXY-3-METHYL-4-(2-PHENYLDIAZENYL)-1H-PYRAZOL-1-YL)-
Systematic Name English
BENZENESULFONIC ACID, 4-(4,5-DIHYDRO-3-METHYL-5-OXO-4-(2-PHENYLDIAZENYL)-1H-PYRAZOL-1-YL)-
Systematic Name English
C.I. ACID YELLOW 11, FREE ACID
Common Name English
BENZENESULFONIC ACID, 4-(4,5-DIHYDRO-3-METHYL-5-OXO-4-(PHENYLAZO)-1H-PYRAZOL-1-YL)-
Systematic Name English
CI ACID YELLOW 11, FREE ACID
Common Name English
BENZENESULFONIC ACID, P-(3-METHYL-5-OXO-4-PHENYLAZO-2-PYRAZOLIN-1-YL)-
Systematic Name English
ACID YELLOW 11 PARENT
Common Name English
Code System Code Type Description
ECHA (EC/EINECS)
247-223-1
Created by admin on Sat Dec 16 08:12:00 GMT 2023 , Edited by admin on Sat Dec 16 08:12:00 GMT 2023
PRIMARY
CAS
1083040-20-3
Created by admin on Sat Dec 16 08:12:00 GMT 2023 , Edited by admin on Sat Dec 16 08:12:00 GMT 2023
ALTERNATIVE
PUBCHEM
61391
Created by admin on Sat Dec 16 08:12:00 GMT 2023 , Edited by admin on Sat Dec 16 08:12:00 GMT 2023
PRIMARY
FDA UNII
Z3CN6SP8WS
Created by admin on Sat Dec 16 08:12:00 GMT 2023 , Edited by admin on Sat Dec 16 08:12:00 GMT 2023
PRIMARY
EPA CompTox
DTXSID0047452
Created by admin on Sat Dec 16 08:12:00 GMT 2023 , Edited by admin on Sat Dec 16 08:12:00 GMT 2023
PRIMARY
CAS
25739-63-3
Created by admin on Sat Dec 16 08:12:00 GMT 2023 , Edited by admin on Sat Dec 16 08:12:00 GMT 2023
PRIMARY
CAS
1217294-80-8
Created by admin on Sat Dec 16 08:12:00 GMT 2023 , Edited by admin on Sat Dec 16 08:12:00 GMT 2023
ALTERNATIVE
Related Record Type Details
SALT/SOLVATE -> PARENT