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Substance Name: 1,1',3,3,3',3'-Hexamethylindotricarbocyanine
RN: 16595-48-5
InChIKey: NHQOULZCPKJYMM-UHFFFAOYSA-M

Molecular Formula

  • C29-H33-N2.Cl-O4

Molecular Weight

  • 509.043
 
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Names and Synonyms

Name of Substance

  • 1,1',3,3,3',3'-Hexamethylindotricarbocyanine

Synonyms

  • 1,3,3-Trimethyl-2-(7-(1,3,3-trimethylindol-2-ylidene)-1,3,5-heptatrienyl)indolium perchlorate
  • EINECS 240-652-5

Systematic Names

  • 2-(7-(1,3-Dihydro-1,3,3-trimethyl-2H-indol-2-ylidene)hepta-1,3,5-trienyl)-1,3,3-trimethyl-3H-indolium perchlorate
  • 3H-Indolium, 2-(7-(1,3-dihydro-1,3,3-trimethyl-2H-indol-2-ylidene)-1,3,5-heptatrien-1-yl)-1,3,3-trimethyl-, perchlorate (1:1)
  • 3H-Indolium, 2-(7-(1,3-dihydro-1,3,3-trimethyl-2H-indol-2-ylidene)-1,3,5-heptatrienyl)-1,3,3-trimethyl-, perchlorate

Registry Numbers

CAS Registry Number

  • 16595-48-5

System Generated Number

  • 0016595485

Molecular Formulas

Molecular Formula

  • C29-H33-N2.Cl-O4

Molecular Formula Fragments

  • C29-H33-N2
  • Cl-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C29H33N2.ClHO4/c1-28(2)22-16-12-14-18-24(22)30(5)26(28)20-10-8-7-9-11-21-27-29(3,4)23-17-13-15-19-25(23)31(27)6;2-1(3,4)5/h7-21H,1-6H3;(H,2,3,4,5)/q+1;/p-1

InChIKey

NHQOULZCPKJYMM-UHFFFAOYSA-M

Smiles

[N+]=1(c2ccccc2C(C)(C)C1\C=C\C=C\C=C\C=C1\N(c2ccccc2C1(C)C)C)C.Cl(=O)(=O)([O-])=O