spadns (Q27270176)

trisodium 4,5-dihydroxy-3-(4-sulphonatophenylazo)naphthalene-2,7-disulphonate (English)

14 October 2016

chemical formula

C₁₆H₉N₂Na₃O₁₁S₃

1 reference

based on heuristic

inferred from SMILES

canonical SMILES

C1=CC(=CC=C1N=NC2=C(C=C3C=C(C=C(C3=C2O)O)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]

1 reference

spadns (English)

14 October 2016

C1=CC(=CC=C1/N=N/C2=C(C=C3C=C(C=C(C3=C2O)O)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]

1 reference

spadns (English)

InChI=1S/C16H12N2O11S3.3Na/c19-12-7-11(31(24,25)26)5-8-6-13(32(27,28)29)15(16(20)14(8)12)18-17-9-1-3-10(4-2-9)30(21,22)23;;;/h1-7,19-20H,(H,21,22,23)(H,24,25,26)(H,27,28,29);;;/q;3*+1/p-3/b18-17+;;;

14 October 2016

Identifiers

InChI

1 reference

AEHGQXKBQBMQEK-GLCFPVLVSA-K

spadns (English)

14 October 2016

1 reference

spadns (English)

14 October 2016

1 reference

spadns (English)

14 October 2016

1 reference

trisodium 4,5-dihydroxy-3-(4-sulphonatophenylazo)naphthalene-2,7-disulphonate (English)

DSSTOX compound identifier

14 October 2016

DSSTox substance ID

DTXSID3066920

0 references

DTXCID6036916

0 references

EC number

245-803-9

1 reference

spadns (English)

ECHA Substance Infocard ID

14 October 2016

100.041.625

1 reference

ECHA Substance Infocard database

ECHA Substance Infocard ID

100.041.625

27 December 2018

AICS Chemical ID (BEING DELETED)

Trisodium 4,5-dihydroxy-3-(4-sulphonatophenylazo)naphthalene-2,7-disulphonate (English)

quotation

CAS no.: 23647-14-5 (English)

0 references

2 references

spadns (English)