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Details

Stereochemistry ACHIRAL
Molecular Formula C37H28N4O10S3.2Na
Molecular Weight 830.814
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 2
Charge 0

SHOW SMILES / InChI
Structure of ACID RED 114

SMILES

[Na+].[Na+].CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)\N=N\C3=CC=C(C=C3C)C4=CC(C)=C(C=C4)\N=N\C5=C(O)C=CC6=CC(=CC(=C56)S([O-])(=O)=O)S([O-])(=O)=O

InChI

InChIKey=HNBQFKZSMFFZQY-WEUAPPMUSA-L
InChI=1S/C37H30N4O10S3.2Na/c1-22-4-13-30(14-5-22)54(49,50)51-29-11-9-28(10-12-29)38-39-32-15-6-25(18-23(32)2)26-7-16-33(24(3)19-26)40-41-37-34(42)17-8-27-20-31(52(43,44)45)21-35(36(27)37)53(46,47)48;;/h4-21,42H,1-3H3,(H,43,44,45)(H,46,47,48);;/q;2*+1/p-2/b39-38+,41-40+;;

HIDE SMILES / InChI

Molecular Formula Na
Molecular Weight 22.9898
Charge 1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C37H28N4O10S3
Molecular Weight 784.834
Charge -2
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 Fri Dec 15 18:30:28 GMT 2023
Edited
by admin
on Fri Dec 15 18:30:28 GMT 2023
Record UNII
P8TW4PSS87
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ACID RED 114
Common Name English
DISODIUM 8-((3,3'-DIMETHYL-4'-(4-(4- METHYLPHENYLSULPHONYLOXY)PHENYLAZO)(1,1'-BIPHENYL)-4- YL)AZO)-7-HYDROXYNAPHTHALENE-1,3-DISULPHONATE
Systematic Name English
POLAR RED RS
Brand Name English
C.I. ACID RED 114 [HSDB]
Common Name English
CI 23635
Common Name English
C.I. ACID RED 114, DISODIUM SALT
Common Name English
CI ACID RED 114 [IARC]
Common Name English
EVERACID MILLING RED RS
Brand Name English
1,3-NAPHTHALENEDISULFONIC ACID, 8-((3,3'-DIMETHYL-4'-((4-(((4-METHYLPHENYL)SULFONYL)OXY)PHENYL)AZO)(1,1'-BIPHENYL)-4-YL)AZO)-7-HYDROXY-, DISODIUM SALT
Systematic Name English
1,3-NAPHTHALENEDISULFONIC ACID, 8-(2-(3,3'-DIMETHYL-4'-(2-(4-(((4-METHYLPHENYL)SULFONYL)OXY)PHENYL)DIAZENYL)(1,1'-BIPHENYL)-4-YL)DIAZENYL)-7-HYDROXY-, SODIUM SALT (1:2)
Systematic Name English
CI ACID RED 114
Common Name English
C.I. ACID RED 114
HSDB  
Common Name English
Code System Code Type Description
ECHA (EC/EINECS)
229-272-0
Created by admin on Fri Dec 15 18:30:28 GMT 2023 , Edited by admin on Fri Dec 15 18:30:28 GMT 2023
PRIMARY
CAS
6459-94-5
Created by admin on Fri Dec 15 18:30:28 GMT 2023 , Edited by admin on Fri Dec 15 18:30:28 GMT 2023
PRIMARY
FDA UNII
P8TW4PSS87
Created by admin on Fri Dec 15 18:30:28 GMT 2023 , Edited by admin on Fri Dec 15 18:30:28 GMT 2023
PRIMARY
HSDB
5180
Created by admin on Fri Dec 15 18:30:28 GMT 2023 , Edited by admin on Fri Dec 15 18:30:28 GMT 2023
PRIMARY
EPA CompTox
DTXSID8021224
Created by admin on Fri Dec 15 18:30:28 GMT 2023 , Edited by admin on Fri Dec 15 18:30:28 GMT 2023
PRIMARY