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N-[4-[Bis[4-(2-carboxyethoxy)phenyl]methylene]-2,5-cyclohexadien-1-ylidene]-N-methylmethanaminium

N-[4-[Bis[4-(2-carboxyethoxy)phenyl]methylene]-2,5-cyclohexadien-1-ylidene]-N-methylmethanaminium structure

CAS No:
69059-95-6
Formula:
C27H28NO6
Chemical Name:
N-[4-[Bis[4-(2-carboxyethoxy)phenyl]methylene]-2,5-cyclohexadien-1-ylidene]-N-methylmethanaminium
Synonyms:
Methanaminium,N-[4-[bis[4-(2-carboxyethoxy)phenyl]methylene]-2,5-cyclohexadien-1-ylidene]-N-methyl-;N-[4-[Bis[4-(2-carboxyethoxy)phenyl]methylene]-2,5-cyclohexadien-1-ylidene]-N-methylmethanaminium;[4-[4,4′-Bis-(2-carboxyethoxy)benzhydrylidene]cyclohexa-2,5-dien-1-ylidene]dimethylammonium

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N-[4-[Bis[4-(2-carboxyethoxy)phenyl]methylene]-2,5-cyclohexadien-1-ylidene]-N-methylmethanaminium Basic Attributes

Molecular Weight：

480.55278

Exact Mass：

480.226

EC Number：

273-848-4

DSSTox ID：

DTXSID20219117

Characteristics

PSA：

148

XLogP3：

-2.1

Computed Properties

Molecular Weight:480.6
XLogP3:-2.1
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:12
Exact Mass:480.22603674
Monoisotopic Mass:480.22603674
Topological Polar Surface Area:148
Heavy Atom Count:35
Formal Charge:2
Complexity:741
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of N-[4-[Bis[4-(2-carboxyethoxy)phenyl]methylene]-2,5-cyclohexadien-1-ylidene]-N-methylmethanaminium

Basic Attributes
Characteristics
Computed Properties

N-[4-[Bis[4-(2-carboxyethoxy)phenyl]methylene]-2,5-cyclohexadien-1-ylidene]-N-methylmethanaminium

SDS

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