Benzothiazolium, 2-[2-methyl-3-[3-(4-sulfobutyl)-2(3H)-benzothiazolylidene]-1-propen-1-yl]-3-(4-sulfobutyl)-, inner salt, compd. with N,N-diethylethanamine (1:1)
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Benzothiazolium, 2-[2-methyl-3-[3-(4-sulfobutyl)-2(3H)-benzothiazolylidene]-1-propen-1-yl]-3-(4-sulfobutyl)-, inner salt, compd. with N,N-diethylethanamine (1:1)
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CAS No:
37966-23-7
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Formula:
C26H30N2O6S4.C6H15N
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Chemical Name:
Benzothiazolium, 2-[2-methyl-3-[3-(4-sulfobutyl)-2(3H)-benzothiazolylidene]-1-propen-1-yl]-3-(4-sulfobutyl)-, inner salt, compd. with N,N-diethylethanamine (1:1)
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Synonyms:
Benzothiazolium,2-[2-methyl-3-[3-(4-sulfobutyl)-2(3H)-benzothiazolylidene]-1-propen-1-yl]-3-(4-sulfobutyl)-,inner salt,compd. with N,N-diethylethanamine (1:1);Benzothiazolium,2-[2-methyl-3-[3-(4-sulfobutyl)-2(3H)-benzothiazolylidene]-1-propenyl]-3-(4-sulfobutyl)-,hydroxide,inner salt,compd. with N,N-diethylethanamine (1:1);Benzothiazolium,2-[2-methyl-3-[3-(4-sulfobutyl)-2(3H)-benzothiazolylidene]-1-propenyl]-3-(4-sulfobutyl)-,inner salt,compd. with N,N-diethylethanamine (1:1);Ethanamine,N,N-diethyl-,compd. with 2-[2-methyl-3-[3-(4-sulfobutyl)-2(3H)-benzothiazolylidene]-1-propenyl]-3-(4-sulfobutyl)benzothiazolium hydroxide inner salt (1:1);65184-26-1
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CAS No:
Benzothiazolium, 2-[2-methyl-3-[3-(4-sulfobutyl)-2(3H)-benzothiazolylidene]-1-propen-1-yl]-3-(4-sulfobutyl)-, inner salt, compd. with N,N-diethylethanamine (1:1) Basic Attributes
696.0 g/mol
695.21912086 g/mol
253-731-4
Benzothiazolium, 2-[2-methyl-3-[3-(4-sulfobutyl)-2(3H)-benzothiazolylidene]-1-propen-1-yl]-3-(4-sulfobutyl)-, inner salt, compd. with N,N-diethylethanamine (1:1) Use and Manufacturing
Benzothiazolium, 2-[2-methyl-3-[3-(4-sulfobutyl)-2(3H)-benzothiazolylidene]-1-propen-1-yl]-3-(4-sulfobutyl)-, inner salt, compd. with N,N-diethylethanamine (1:1): ACTIVE
Computed Properties
Molecular Weight:696.0
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:10
Rotatable Bond Count:14
Exact Mass:695.21912086
Monoisotopic Mass:695.21912086
Topological Polar Surface Area:192
Heavy Atom Count:45
Complexity:1080
Undefined Bond Stereocenter Count:2
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes
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Benzothiazolium, 5-chloro-2-[2-[[5-chloro-3-(3-sulfopropyl)-2(3H)-benzothiazolylidene]methyl]-1-buten-1-yl]-3-(3-sulfopropyl)-, inner salt, compd with N,N-diethylethanamine (1:1) Structure
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92771-38-5
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