Benzothiazolium, 3-butyl-2-[3-(3-butyl-2(3H)-benzothiazolylidene)-2-methyl-1-propen-1-yl]-, iodide (1:1)
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![Benzothiazolium, 3-butyl-2-[3-(3-butyl-2(3H)-benzothiazolylidene)-2-methyl-1-propen-1-yl]-, iodide (1:1) structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/82f4c185681d4b558f99f59242378a75.png "Benzothiazolium, 3-butyl-2-[3-(3-butyl-2(3H)-benzothiazolylidene)-2-methyl-1-propen-1-yl]-, iodide (1:1)")
Benzothiazolium, 3-butyl-2-[3-(3-butyl-2(3H)-benzothiazolylidene)-2-methyl-1-propen-1-yl]-, iodide (1:1)
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CAS No:
17636-07-6
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Formula:
C26H31N2S2.I
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Chemical Name:
Benzothiazolium, 3-butyl-2-[3-(3-butyl-2(3H)-benzothiazolylidene)-2-methyl-1-propen-1-yl]-, iodide (1:1)
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Synonyms:
Benzothiazolium,3-butyl-2-[3-(3-butyl-2(3H)-benzothiazolylidene)-2-methyl-1-propen-1-yl]-,iodide (1:1);Benzothiazolium,3-butyl-2-[3-(3-butyl-2-benzothiazolinylidene)-2-methylpropenyl]-,iodide;Benzothiazolium,3-butyl-2-[3-(3-butyl-2(3H)-benzothiazolylidene)-2-methyl-1-propenyl]-,iodide;Thiacarbocyanine iodide,3,3′-dibutyl-;3,3′-Dibutyl-9-methylthiacarbocyanine,iodide;116777-25-4;1655516-06-5
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CAS No:
Benzothiazolium, 3-butyl-2-[3-(3-butyl-2(3H)-benzothiazolylidene)-2-methyl-1-propen-1-yl]-, iodide (1:1) Basic Attributes
562.57221
562.097
241-619-8
Computed Properties
Molecular Weight:562.6
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:8
Exact Mass:562.09734
Monoisotopic Mass:562.09734
Topological Polar Surface Area:60.7
Heavy Atom Count:31
Complexity:565
Defined Bond Stereocenter Count:2
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes
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