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Substance Name: Dibenzo(b,def)chrysene-7,14-diol, 7,14-bis(hydrogen sulfate), sodium salt (1:2)
RN: 3564-70-3
InChIKey: DLIHJRCWNWWTSF-UHFFFAOYSA-L

Molecular Formula

  • C24-H14-O8-S2.2Na

Molecular Weight

  • 538.463
 
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Names and Synonyms

Synonym

  • EINECS 222-648-5

Systematic Names

  • Dibenzo(b,def)chrysene-7,14-diol, 7,14-bis(hydrogen sulfate), sodium salt (1:2)
  • Dibenzo(b,def)chrysene-7,14-diol, bis(hydrogen sulfate), disodium salt
  • Disodium dibenzo(b,def)chrysene-7,14-diyl bis(sulphate)

Registry Numbers

CAS Registry Number

  • 3564-70-3

System Generated Number

  • 0003564703

Molecular Formulas

Molecular Formula

  • C24-H14-O8-S2.2Na

Molecular Formula Fragments

  • C24-H14-O8-S2
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C24H14O8S2.2Na/c25-33(26,27)31-23-17-7-3-1-5-13(17)15-9-11-20-22-16(10-12-19(23)21(15)22)14-6-2-4-8-18(14)24(20)32-34(28,29)30;;/h1-12H,(H,25,26,27)(H,28,29,30);;/q;2*+1/p-2

InChIKey

DLIHJRCWNWWTSF-UHFFFAOYSA-L

Smiles

c12c3c4ccc1c(OS(=O)(=O)[O-])c1c(c2ccc3c(OS(=O)(=O)[O-])c2c4cccc2)cccc1.[Na+].[Na+]