3H-Indolium, 2-[3-chloro-5-(1-decyl-1,3-dihydro-3,3-dimethyl-2H-indol-2-ylidene)-1,3-pentadien-1-yl]-1-decyl-3,3-dimethyl-, perchlorate (1:1)

CAS Registry Number®

166317-60-8
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CAS Name

3H-Indolium, 2-[3-chloro-5-(1-decyl-1,3-dihydro-3,3-dimethyl-2H-indol-2-ylidene)-1,3-pentadien-1-yl]-1-decyl-3,3-dimethyl-, perchlorate (1:1)

Molecular Formula

C45H66ClN2.ClO4

Cite this Page

3H-Indolium, 2-[3-chloro-5-(1-decyl-1,3-dihydro-3,3-dimethyl-2H-indol-2-ylidene)-1,3-pentadien-1-yl]-1-decyl-3,3-dimethyl-, perchlorate (1:1).   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=166317-60-8 (retrieved 2024-09-09) (CAS RN: 166317-60-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C45H66ClN2.ClHO4/c1-7-9-11-13-15-17-19-25-35-47-40-29-23-21-27-38(40)44(3,4)42(47)33-31-37(46)32-34-43-45(5,6)39-28-22-24-30-41(39)48(43)36-26-20-18-16-14-12-10-8-2;2-1(3,4)5/h21-24,27-34H,7-20,25-26,35-36H2,1-6H3;(H,2,3,4,5)/q+1;/p-1

InChIKey

InChIKey=NSVITLCIMBUAMU-UHFFFAOYSA-M

SMILES

C(CCCCCCCCC)N1C=2C(C(C)(C)C1=CC=C(C=CC3=[N+](CCCCCCCCCC)C=4C(C3(C)C)=CC=CC4)Cl)=CC=CC2.Cl(=O)(=O)(=O)[O-]

Canonical SMILES

O=Cl(=O)(=O)[O-].ClC(=CC=C1N(C=2C=CC=CC2C1(C)C)CCCCCCCCCC)C=CC3=[N+](C=4C=CC=CC4C3(C)C)CCCCCCCCCC

Other Names for this Substance

  • 3H-Indolium, 2-[3-chloro-5-(1-decyl-1,3-dihydro-3,3-dimethyl-2H-indol-2-ylidene)-1,3-pentadien-1-yl]-1-decyl-3,3-dimethyl-, perchlorate (1:1)
  • 3H-Indolium, 2-[3-chloro-5-(1-decyl-1,3-dihydro-3,3-dimethyl-2H-indol-2-ylidene)-1,3-pentadienyl]-1-decyl-3,3-dimethyl-, perchlorate