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[2-(2,5-dimethylanilino)-2-oxoethyl] 1-oxidopyridin-1-ium-3-carboxylate

[2-(2,5-dimethylanilino)-2-oxoethyl] 1-oxidopyridin-1-ium-3-carboxylate structure

CAS No:
722471-47-8
Formula:
C16H16N2O4
Chemical Name:
[2-(2,5-dimethylanilino)-2-oxoethyl] 1-oxidopyridin-1-ium-3-carboxylate
Synonyms:
Enamine_004725;MLS002246565;CHEMBL1895683;HMS1407G17;HMS3093B06;ZINC3313469;AKOS033631237;SMR001310173;SR-01000038217;SR-01000038217-1;Z18554620;3-({[(2,5-dimethylphenyl)carbamoyl]methoxy}carbonyl)pyridin-1-ium-1-olate;722471-47-8

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[2-(2,5-dimethylanilino)-2-oxoethyl] 1-oxidopyridin-1-ium-3-carboxylate Basic Attributes

Molecular Weight：

300.31 g/mol

Exact Mass：

300.11100700 g/mol

Characteristics

PSA：

80.9 Å²

Water Solubility：

>45 [ug/mL]

Computed Properties

Molecular Weight:300.31
XLogP3:1.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:300.11100700
Monoisotopic Mass:300.11100700
Topological Polar Surface Area:80.9
Heavy Atom Count:22
Complexity:402
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Hot Searches: 2-naphthol reacting with naoh formula; keratomalacia; phenylmagnesium bromide; clopidogrel bisulfate 75 mg; dcm boiling point; hexanol

Guide of [2-(2,5-dimethylanilino)-2-oxoethyl] 1-oxidopyridin-1-ium-3-carboxylate

Basic Attributes
Characteristics
Computed Properties
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