α,α-Bis(hydroxymethyl)benzeneacetic acid (1R,5S)-8-methyl-8-azabicyclo[3.2.1]oct-3α-yl ester

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α,α-Bis(hydroxymethyl)benzeneacetic acid (1R,5S)-8-methyl-8-azabicyclo[3.2.1]oct-3α-yl ester Basic information
Product Name:α,α-Bis(hydroxymethyl)benzeneacetic acid (1R,5S)-8-methyl-8-azabicyclo[3.2.1]oct-3α-yl ester
Synonyms:α,α-Bis(hydroxymethyl)benzeneacetic acid (1R,5S)-8-methyl-8-azabicyclo[3.2.1]oct-3α-yl ester;2-(HydroxyMethyl)-2-phenyl-hydracrylic Acid 3α-Tropanyl Ester;1αH,5αH-Tropan-3α-ol, 2-(hydroxymethyl)-2-phenylhydracylate (ester) (8CI);α-Hydroxymethyl Atropine;1αH,5αH-Tropan-3α-ol, 2-(hydroxymethyl)-2-phenylhydracylate (ester);Atropine Impurity 45;rel-(1R,3r,5S)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl 3-hydroxy-2-(hydroxymethyl)-2-phenylpropanoate;a-Hydroxymethyl Atropine
CAS:2515-36-8
MF:C18H25NO4
MW:319.4
EINECS:
Product Categories:Aromatics, Heterocycles, Pharmaceuticals, Intermediates & Fine Chemicals
Mol File:2515-36-8.mol
α,α-Bis(hydroxymethyl)benzeneacetic acid (1R,5S)-8-methyl-8-azabicyclo[3.2.1]oct-3α-yl ester Structure
α,α-Bis(hydroxymethyl)benzeneacetic acid (1R,5S)-8-methyl-8-azabicyclo[3.2.1]oct-3α-yl ester Chemical Properties
Boiling point 489.2±45.0 °C(Predicted)
density 1.24±0.1 g/cm3(Predicted)
solubility DMF: 2 mg/ml; DMSO: 10 mg/ml; Ethanol: 16 mg/ml; PBS (pH 7.2): 10 mg/ml
form A crystalline solid
pka13.14±0.10(Predicted)
Safety Information
MSDS Information
α,α-Bis(hydroxymethyl)benzeneacetic acid (1R,5S)-8-methyl-8-azabicyclo[3.2.1]oct-3α-yl ester Usage And Synthesis
Descriptionα-Hydroxymethyl atropine is a byproduct in the synthesis of atropine. It reduces acetylcholine-induced contractile activity of isolated rat intestine when used at a concentration of 0.025 ng/ml.
UsesByproduct produced in the preparation of Atropine.
References[1] CHUNHUI DAI. Continuous-Flow Synthesis and Purification of Atropine with Sequential In-Line Separations of Structurally Similar Impurities[J]. Journal of Flow Chemistry, 2015, 5 3: 133-138. DOI: 10.1556/1846.2015.00013
[2] VENIERO SCARSELLI  Giulio M  Giorgio Cignarella. Structural Changes and Anticholinergic Activity in a Class of Tropic and α-Methyltropic Acid Derivatives[J]. Journal of Medicinal Chemistry, 1964, 7 2: 237-238. DOI: 10.1021/jm00332a026
α,α-Bis(hydroxymethyl)benzeneacetic acid (1R,5S)-8-methyl-8-azabicyclo[3.2.1]oct-3α-yl ester Preparation Products And Raw materials
Tag:α,α-Bis(hydroxymethyl)benzeneacetic acid (1R,5S)-8-methyl-8-azabicyclo[3.2.1]oct-3α-yl ester(2515-36-8) Related Product Information
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