D&amp;c red no. 6 barium lake (Q27281965)

Barium 3-hydroxy-4-((4-methyl-2-sulphonatophenyl)azo)-2-naphthoate (English)

14 October 2016

chemical formula

C₁₈H₁₂BaN₂O₆S

1 reference

based on heuristic

inferred from SMILES

canonical SMILES

CC1=CC=C(C(=C1)S(=O)(=O)[O-])N=NC2=C3C=CC=CC3=CC(=C2O)C(=O)[O-].[Ba+2]

1 reference

D&c red no. 6 barium lake (English)

20 November 2016

isomeric SMILES

CC1=CC=C(C(=C1)S(=O)(=O)[O-])/N=N/C2=C3C=CC=CC3=CC(=C2O)C(=O)[O-].[Ba+2]

1 reference

D&c red no. 6 barium lake (English)

InChI=1S/C18H14N2O6S.Ba/c1-10-6-7-14(15(8-10)27(24,25)26)19-20-16-12-5-3-2-4-11(12)9-13(17(16)21)18(22)23;/h2-9,21H,1H3,(H,22,23)(H,24,25,26);/q;+2/p-2/b20-19+;

20 November 2016

Identifiers

InChI

1 reference

D&c red no. 6 barium lake (English)

GSEGKBMSKPDICA-RZLHGTIFSA-L

20 November 2016

InChIKey

1 reference

D&c red no. 6 barium lake (English)

20 November 2016

1 reference

D&c red no. 6 barium lake (English)

20 November 2016

1 reference

DSSTOX compound identifier

Barium 3-hydroxy-4-((4-methyl-2-sulphonatophenyl)azo)-2-naphthoate (English)

20 November 2016

0 references

0 references

DTXCID801024405

0 references

EC number

241-806-4

1 reference

D&c red no. 6 barium lake (English)

ECHA Substance Infocard ID

20 November 2016

100.037.991

1 reference

ECHA Substance Infocard database

ECHA Substance Infocard ID

100.037.991

27 December 2018

AICS Chemical ID (BEING DELETED)

Barium 3-hydroxy-4-[(4-methyl-2-sulphonatophenyl)azo]-2-naphthoate (English)

quotation

CAS no.: 17852-98-1 (English)

0 references

1 reference

D&c red no. 6 barium lake (English)

20 November 2016

2 references

D&c red no. 6 barium lake (English)