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[3-(2-methyl-1-oxo-1-phenylpropan-2-yl)imidazol-1-ium-1-yl]methyl dodecanoate;chloride

[3-(2-methyl-1-oxo-1-phenylpropan-2-yl)imidazol-1-ium-1-yl]methyl dodecanoate;chloride structure

CAS No:
111076-90-5
Formula:
C26H39ClN2O3
Chemical Name:
[3-(2-methyl-1-oxo-1-phenylpropan-2-yl)imidazol-1-ium-1-yl]methyl dodecanoate;chloride
Synonyms:
111076-90-5;NKI 9995;DTXSID60911986;1H-Imidazolium, 1-(1,1-dimethyl-2-oxo-2-phenylethyl)-3-(((1-oxododecyl)oxy)methyl)-, chloride;3-[(Dodecanoyloxy)methyl]-1-(2-methyl-1-oxo-1-phenylpropan-2-yl)-1H-imidazol-3-ium chloride

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[3-(2-methyl-1-oxo-1-phenylpropan-2-yl)imidazol-1-ium-1-yl]methyl dodecanoate;chloride Basic Attributes

Molecular Weight：

463.1 g/mol

Exact Mass：

462.2649208 g/mol

Characteristics

PSA：

52.2 Å²

Computed Properties

Molecular Weight:463.1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:16
Exact Mass:462.2649208
Monoisotopic Mass:462.2649208
Topological Polar Surface Area:52.2
Heavy Atom Count:32
Complexity:529
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes

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Guide of [3-(2-methyl-1-oxo-1-phenylpropan-2-yl)imidazol-1-ium-1-yl]methyl dodecanoate;chloride

Basic Attributes
Characteristics
Computed Properties

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