polar yellow (Q27270222)

Polar Yellow (English)

14 October 2016

chemical formula

C₂₃H₁₈ClN₄NaO₇S₂

1 reference

based on heuristic

inferred from SMILES

canonical SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)N=NC=3C(=NN(C3O)C4=CC=C(C=C4S(=O)(=O)[O-])Cl)C.[Na+]

1 reference

polar yellow (English)

14 October 2016

isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)/N=N/C=3C(=NN(C3O)C4=CC=C(C=C4S(=O)(=O)[O-])Cl)C.[Na+]

1 reference

polar yellow (English)

InChI=1S/C23H19ClN4O7S2.Na/c1-14-3-10-19(11-4-14)37(33,34)35-18-8-6-17(7-9-18)25-26-22-15(2)27-28(23(22)29)20-12-5-16(24)13-21(20)36(30,31)32;/h3-13,29H,1-2H3,(H,30,31,32);/q;+1/p-1/b26-25+;

14 October 2016

Identifiers

InChI

1 reference

polar yellow (English)

UMQAIKKJIZYHQC-BTKVJIOYSA-M

14 October 2016

InChIKey

1 reference

polar yellow (English)

14 October 2016

1 reference

polar yellow (English)

14 October 2016

1 reference

Polar Yellow (English)

DSSTOX compound identifier

14 October 2016

DSSTox substance ID

DTXSID70884278

0 references

0 references

0 references

228-907-9

1 reference

polar yellow (English)

ECHA Substance Infocard ID

14 October 2016

100.026.280

1 reference

ECHA Substance Infocard database

ECHA Substance Infocard ID

100.026.280

27 December 2018

Sodium 5-chloro-2-(5-hydroxy-3-methyl-4-(4-((4-methylphenyl)sulphonyloxy)phenylazo)pyrazol-1-yl)benzenesulphonate (English)

quotation

CAS no.: 6372-96-9 (English)

2 references

polar yellow (English)