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

Details

Stereochemistry ACHIRAL
Molecular Formula C20H17ClN4O2
Molecular Weight 380.828
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 2
Charge 0

SHOW SMILES / InChI
Structure of 4,4'-((CHLORO-P-PHENYLENE)BIS(AZO))DI-O-CRESOL

SMILES

CC1=CC(=CC=C1O)\N=N\C2=CC=C(C=C2Cl)\N=N\C3=CC(C)=C(O)C=C3

InChI

InChIKey=UVZYLHBBQONCRZ-VTJHEJDCSA-N
InChI=1S/C20H17ClN4O2/c1-12-9-14(4-7-19(12)26)22-23-16-3-6-18(17(21)11-16)25-24-15-5-8-20(27)13(2)10-15/h3-11,26-27H,1-2H3/b23-22+,25-24+

HIDE SMILES / InChI

Molecular Formula C20H17ClN4O2
Molecular Weight 380.828
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 2
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 18:35:57 GMT 2025
Edited
by admin
on Mon Mar 31 18:35:57 GMT 2025
Record UNII
JY3JC98C2A
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4,4'-((CHLORO-P-PHENYLENE)BIS(AZO))DI-O-CRESOL
Common Name English
PHENOL, 4,4'-((2-CHLORO-1,4-PHENYLENE)BIS(2,1-DIAZENEDIYL))BIS(2-METHYL-
Preferred Name English
PHENOL, 4,4'-((2-CHLORO-1,4-PHENYLENE)BIS(AZO))BIS(2-METHYL-
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID3063671
Created by admin on Mon Mar 31 18:35:57 GMT 2025 , Edited by admin on Mon Mar 31 18:35:57 GMT 2025
PRIMARY
FDA UNII
JY3JC98C2A
Created by admin on Mon Mar 31 18:35:57 GMT 2025 , Edited by admin on Mon Mar 31 18:35:57 GMT 2025
PRIMARY
ECHA (EC/EINECS)
225-658-8
Created by admin on Mon Mar 31 18:35:57 GMT 2025 , Edited by admin on Mon Mar 31 18:35:57 GMT 2025
PRIMARY
CAS
4998-23-6
Created by admin on Mon Mar 31 18:35:57 GMT 2025 , Edited by admin on Mon Mar 31 18:35:57 GMT 2025
PRIMARY