1,1′,3,3,3′,3′-Hexamethylindodicarbocyanine iodide
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1,1′,3,3,3′,3′-Hexamethylindodicarbocyanine iodide
structure -
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CAS No:
36536-22-8
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Formula:
C27H31N2.I
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Chemical Name:
1,1′,3,3,3′,3′-Hexamethylindodicarbocyanine iodide
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Synonyms:
3H-Indolium,2-[5-(1,3-dihydro-1,3,3-trimethyl-2H-indol-2-ylidene)-1,3-pentadien-1-yl]-1,3,3-trimethyl-,iodide (1:1);3H-Indolium,2-[5-(1,3-dihydro-1,3,3-trimethyl-2H-indol-2-ylidene)-1,3-pentadienyl]-1,3,3-trimethyl-,iodide;1,3,3-Trimethyl-2-[5-(1,3,3-trimethyl-2-indolinylidene)-1,3-pentadienyl]-3H-indolium iodide;1,3,3,1′,3′,3′-Hexamethylindoledicarbocyanine iodide;NK 529;1,1′,3,3,3′,3′-Hexamethylindoledicarbocyanine iodide;HIDC;PK 643;SNC 6;Hexacyanine 2;1,1′,3,3,3′,3′-Hexamethylindodicarbocyanine iodide;HIDCI;ESNF 10;DiIC1(5);1,1,3,3,3′,3′-Hexamethylindodicarbocyanine iodide;149370-68-3
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CAS No:
1,1′,3,3,3′,3′-Hexamethylindodicarbocyanine iodide Basic Attributes
510.45
510.15320 g/mol
253-091-6
Safety Information
36/37/38-20/21/22
24/25-36-26
Xi,Xn
|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501|Aggregated GHS information provided by 39 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
1,1′,3,3,3′,3′-Hexamethylindodicarbocyanine iodide Use and Manufacturing
Hexacyanine 2 is a known synthetic biological stain that is used in photodynamic therapy. Recent research has focused on the development of the combination of a photosensitizer with photoprotector cya nine dye as a novel antitumor strategy for the eradication of malignant cells expressing the multidrug-resistance phenotype.
3H-Indolium, 2-[5-(1,3-dihydro-1,3,3-trimethyl-2H-indol-2-ylidene)-1,3-pentadien-1-yl]-1,3,3-trimethyl-, iodide (1:1): INACTIVE
Computed Properties
Molecular Weight:510.5
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:510.15320
Monoisotopic Mass:510.15320
Topological Polar Surface Area:6.2
Heavy Atom Count:30
Complexity:689
Undefined Bond Stereocenter Count:3
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes
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