Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: 2-(4,5-Dibromo-3,6-dihydroxyxanthen-9-yl)benzoic acid, zirconium salt
RN: 93980-88-2
InChIKey: YJJKWGHKLPSSAI-UHFFFAOYSA-J

Molecular Formula

  • C20-H10-Br2-O5.x-Zr

Molecular Weight

  • 2055.6636
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Synonym

  • EINECS 301-068-7

Systematic Name

  • 2-(4,5-Dibromo-3,6-dihydroxyxanthen-9-yl)benzoic acid, zirconium salt

Registry Numbers

CAS Registry Number

  • 93980-88-2

System Generated Number

  • 0093980882

Molecular Formulas

Molecular Formula

  • C20-H10-Br2-O5.x-Zr

Molecular Formula Fragments

  • C20-H10-Br2-O5
  • COMPONENT
  • Zr

Structure Descriptors

InChI

1S/4C20H12Br2O5.Zr/c4*21-16-13(23)7-5-11-15(9-3-1-2-4-10(9)20(25)26)12-6-8-14(24)17(22)19(12)27-18(11)16;/h4*1-8,15,23-24H,(H,25,26);/q;;;;+4/p-4

InChIKey

YJJKWGHKLPSSAI-UHFFFAOYSA-J

Smiles

[Zr+4].C(=O)(c1c(cccc1)C1c2ccc(c(c2Oc2c(c(ccc12)O)Br)Br)O)[O-].C(=O)(c1c(cccc1)C1c2ccc(c(c2Oc2c(c(ccc12)O)Br)Br)O)[O-].C(=O)(c1c(cccc1)C1c2ccc(c(c2Oc2c(c(ccc12)O)Br)Br)O)[O-].C(=O)(c1c(cccc1)C1c2ccc(c(c2Oc2c(c(ccc12)O)Br)Br)O)[O-]