Benzothiazolium, 3-ethyl-2-[[3-[3-[3-[(3-ethyl-2(3H)-benzothiazolylidene)methyl]-5,5-dimethyl-2-cyclohexen-1-ylidene]-1-propen-1-yl]-5,5-dimethyl-2-cyclohexen-1-ylidene]methyl]-, perchlorate (1:1)
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![Benzothiazolium, 3-ethyl-2-[[3-[3-[3-[(3-ethyl-2(3H)-benzothiazolylidene)methyl]-5,5-dimethyl-2-cyclohexen-1-ylidene]-1-propen-1-yl]-5,5-dimethyl-2-cyclohexen-1-ylidene]methyl]-, perchlorate (1:1) structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220805/18650e9ef657435d879fa5bbb4b44b00.png "Benzothiazolium, 3-ethyl-2-[[3-[3-[3-[(3-ethyl-2(3H)-benzothiazolylidene)methyl]-5,5-dimethyl-2-cyclohexen-1-ylidene]-1-propen-1-yl]-5,5-dimethyl-2-cyclohexen-1-ylidene]methyl]-, perchlorate (1:1)")
Benzothiazolium, 3-ethyl-2-[[3-[3-[3-[(3-ethyl-2(3H)-benzothiazolylidene)methyl]-5,5-dimethyl-2-cyclohexen-1-ylidene]-1-propen-1-yl]-5,5-dimethyl-2-cyclohexen-1-ylidene]methyl]-, perchlorate (1:1)
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CAS No:
65767-27-3
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Formula:
C39H45N2S2.ClO4
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Chemical Name:
Benzothiazolium, 3-ethyl-2-[[3-[3-[3-[(3-ethyl-2(3H)-benzothiazolylidene)methyl]-5,5-dimethyl-2-cyclohexen-1-ylidene]-1-propen-1-yl]-5,5-dimethyl-2-cyclohexen-1-ylidene]methyl]-, perchlorate (1:1)
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Synonyms:
Benzothiazolium,3-ethyl-2-[[3-[3-[3-[(3-ethyl-2(3H)-benzothiazolylidene)methyl]-5,5-dimethyl-2-cyclohexen-1-ylidene]-1-propen-1-yl]-5,5-dimethyl-2-cyclohexen-1-ylidene]methyl]-,perchlorate (1:1);Benzothiazolium,3-ethyl-2-[[3-[3-[3-[(3-ethyl-2(3H)-benzothiazolylidene)methyl]-5,5-dimethyl-2-cyclohexen-1-ylidene]-1-propenyl]-5,5-dimethyl-2-cyclohexen-1-ylidene]methyl]-,perchlorate;3,3′-Diethyl-9,11,15,17-dineopentylene-thiapentacarbocyanine perchlorate;DNP 1020
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CAS No:
Benzothiazolium, 3-ethyl-2-[[3-[3-[3-[(3-ethyl-2(3H)-benzothiazolylidene)methyl]-5,5-dimethyl-2-cyclohexen-1-ylidene]-1-propen-1-yl]-5,5-dimethyl-2-cyclohexen-1-ylidene]methyl]-, perchlorate (1:1) Basic Attributes
705.3686
704.251
265-913-0
Computed Properties
Molecular Weight:705.4
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:6
Exact Mass:704.2509280
Monoisotopic Mass:704.2509280
Topological Polar Surface Area:135
Heavy Atom Count:48
Complexity:1220
Defined Bond Stereocenter Count:4
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes
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Benzothiazolium, 3-ethyl-2-[[3-[3-[3-[(3-ethyl-2(3H)-benzothiazolylidene)methyl]-5,5-dimethyl-2-cyclohexen-1-ylidene]-1-propen-1-yl]-5,5-dimethyl-2-cyclohexen-1-ylidene]methyl]-, iodide (1:1) Formula
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Benzothiazolium, 3-ethyl-2-[[3-[3-[3-[(3-ethyl-2(3H)-benzothiazolylidene)methyl]-5,5-dimethyl-2-cyclohexen-1-ylidene]-1-propen-1-yl]-5,5-dimethyl-2-cyclohexen-1-ylidene]methyl]-, perchlorate (1:1)
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