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Substance Name: Thioflavine phosphomolybdate pigment
RN: 68334-63-4
InChIKey: LLJNPOFVEQIZBK-UHFFFAOYSA-N

Molecular Formula

  • C16-H17-N2-S.1/3Mo12-O40-P

Molecular Weight

  • 840.256
 
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Names and Synonyms

Results Name

  • Thioflavine phosphomolybdate pigment

Synonyms

  • EINECS 269-838-4
  • Thioflavine phosphomolybdate pigment

Systematic Names

  • Benzothiazolium, 2-(4-(dimethylamino)phenyl)-3-methyl-, tetracosa-mu-oxododecaoxo(mu12-(phosphato(3-)-kappaO:kappaO:kappaO:kappaO':kappaO':kappaO':kappaO'':kappaO'':kappaO'':kappaO''':kappaO''':kappaO'''))dodecamolybdate(3-) (3:1)
  • Benzothiazolium, 2-(4-(dimethylamino)phenyl)-3-methyl-, tetracosa-mu-oxododecaoxo(mu12-(phosphato(3-)-O:O:O:O':O':O':O'':O'':O'':O''':O''':O'''))dodecamolybdate(3-) (3:1)
  • Tris(2-(4-(dimethylamino)phenyl)-3-methylbenzothiazolium) tetracosaoxododecaoxo(mu12-(phosphato(3-)-O:O:O:O':O':O':O'':O'':O'':O''':O''':O'''))dodecamolybdate(3-) C16H17N2S.1/3Mo12O40P

Registry Numbers

CAS Registry Number

  • 68334-63-4

System Generated Number

  • 0068334634

Molecular Formulas

Molecular Formula

  • C16-H17-N2-S.1/3Mo12-O40-P

Molecular Formula Fragments

  • C16-H17-N2-S
  • COMPONENT
  • Mo12-O40-P

Structure Descriptors

InChI

1S/3C16H17N2S.2CH4/c3*1-17(2)13-10-8-12(9-11-13)16-18(3)14-6-4-5-7-15(14)19-16;;/h3*4-11H,1-3H3;2*1H4/q3*+1;;

InChIKey

LLJNPOFVEQIZBK-UHFFFAOYSA-N

Smiles

[n+]1(c(sc2c1cccc2)c1ccc(cc1)N(C)C)C.C.C.[n+]1(C)c(sc2ccccc12)c1ccc(N(C)C)cc1.[n+]1(C)c(sc2ccccc12)c1ccc(N(C)C)cc1