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Quinolinium, 1-ethyl-4-[(3-ethyl-2(3H)-benzothiazolylidene)methyl]-, iodide (1:1)

Quinolinium, 1-ethyl-4-[(3-ethyl-2(3H)-benzothiazolylidene)methyl]-, iodide (1:1) structure

CAS No:
15941-82-9
Formula:
C21H21N2S.I
Chemical Name:
Quinolinium, 1-ethyl-4-[(3-ethyl-2(3H)-benzothiazolylidene)methyl]-, iodide (1:1)
Synonyms:
Quinolinium,1-ethyl-4-[(3-ethyl-2(3H)-benzothiazolylidene)methyl]-,iodide (1:1);Quinolinium,1-ethyl-4-[(3-ethyl-2(3H)-benzothiazolylidene)methyl]-,iodide;3-Ethyl-2-[(1-ethyl-4(1H)-quinolylidene)methyl]benzothiazolium iodide;1,3′-Diethyl-4,2′-quinolylthiacyanine iodide;NK 750;57282-58-3;1883542-22-0

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Quinolinium, 1-ethyl-4-[(3-ethyl-2(3H)-benzothiazolylidene)methyl]-, iodide (1:1) Basic Attributes

Molecular Weight：

460.37400

Exact Mass：

460.04702 g/mol

Characteristics

PSA：

37.05000

XLogP3：

1.29720

Melting Point：

272-274ºC

Safety Information

wgk germany：

safety instructions：

S22; S24/25

Computed Properties

Molecular Weight:460.4
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:460.04702
Monoisotopic Mass:460.04702
Topological Polar Surface Area:32.4
Heavy Atom Count:25
Complexity:463
Undefined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes

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Guide of Quinolinium, 1-ethyl-4-[(3-ethyl-2(3H)-benzothiazolylidene)methyl]-, iodide (1:1)

Basic Attributes
Characteristics
Safety Information
Computed Properties
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