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Details

Stereochemistry ACHIRAL
Molecular Formula C18H14Cl2N8O9S2.2Na
Molecular Weight 667.367
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of REACTIVE YELLOW 86

SMILES

[Na+].[Na+].CCN1C(=O)C(C(N)=O)=C(C)C(\N=N\C2=CC(NC3=NC(Cl)=NC(Cl)=N3)=C(C=C2S([O-])(=O)=O)S([O-])(=O)=O)=C1O

InChI

InChIKey=KTPJWZKVPDUBMJ-YOYNBWDYSA-L
InChI=1S/C18H16Cl2N8O9S2.2Na/c1-3-28-14(30)11(13(21)29)6(2)12(15(28)31)27-26-8-4-7(22-18-24-16(19)23-17(20)25-18)9(38(32,33)34)5-10(8)39(35,36)37;;/h4-5,31H,3H2,1-2H3,(H2,21,29)(H,32,33,34)(H,35,36,37)(H,22,23,24,25);;/q;2*+1/p-2/b27-26+;;

HIDE SMILES / InChI

Molecular Formula C18H14Cl2N8O9S2
Molecular Weight 621.388
Charge -2
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

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

Approval Year

Patents

Patents

Substance Class Chemical
Created
by admin
on Fri Dec 15 19:48:21 GMT 2023
Edited
by admin
on Fri Dec 15 19:48:21 GMT 2023
Record UNII
99955Q89LT
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
REACTIVE YELLOW 86
Common Name English
DISODIUM 4-((5-(AMINOCARBONYL)-1-ETHYL-1,6-DIHYDRO-2-HYDROXY-4-METHYL-6-OXO-3-PYRIDINYL)AZO)-6-((4,6-DICHLORO-1,3,5-TRIAZIN-2-YL)AMINO)-1,3-BENZENEDISULFONATE
Common Name English
C.I. REACTIVE YELLOW 86
Common Name English
PROCION YELLOW
Common Name English
CI 192755
Common Name English
C.I. 192755
Common Name English
1,3-BENZENEDISULFONIC ACID, 4-(2-(5-(AMINOCARBONYL)-1-ETHYL-1,6-DIHYDRO-2-HYDROXY-4-METHYL-6-OXO-3-PYRIDINYL)DIAZENYL)-6-((4,6-DICHLORO-1,3,5-TRIAZIN-2-YL)AMINO)-, SODIUM SALT (1:2)
Systematic Name English
Code System Code Type Description
CAS
70865-29-1
Created by admin on Fri Dec 15 19:48:21 GMT 2023 , Edited by admin on Fri Dec 15 19:48:21 GMT 2023
PRIMARY
FDA UNII
99955Q89LT
Created by admin on Fri Dec 15 19:48:21 GMT 2023 , Edited by admin on Fri Dec 15 19:48:21 GMT 2023
PRIMARY
EPA CompTox
DTXSID40890104
Created by admin on Fri Dec 15 19:48:21 GMT 2023 , Edited by admin on Fri Dec 15 19:48:21 GMT 2023
PRIMARY
ECHA (EC/EINECS)
274-956-4
Created by admin on Fri Dec 15 19:48:21 GMT 2023 , Edited by admin on Fri Dec 15 19:48:21 GMT 2023
PRIMARY
CAS
61951-86-8
Created by admin on Fri Dec 15 19:48:21 GMT 2023 , Edited by admin on Fri Dec 15 19:48:21 GMT 2023
ALTERNATIVE