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

Product Name: α,α-Bis(hydroxymethyl)benzeneacetic acid (1R,5S)-8-methyl-8-azabicyclo[3.2.1]oct-3α-yl ester
CAS No.: 2515-36-8
Chemical Name: α,α-Bis(hydroxymethyl)benzeneacetic acid (1R,5S)-8-methyl-8-azabicyclo[3.2.1]oct-3α-yl ester
Synonyms: Atropine Impurity 45;α-Hydroxymethyl Atropine;2-(HydroxyMethyl)-2-phenyl-hydracrylic Acid 3α-Tropanyl Ester;1αH,5αH-Tropan-3α-ol, 2-(hydroxymethyl)-2-phenylhydracylate (ester);1αH,5αH-Tropan-3α-ol, 2-(hydroxymethyl)-2-phenylhydracylate (ester) (8CI);α,α-Bis(hydroxymethyl)benzeneacetic acid (1R,5S)-8-methyl-8-azabicyclo[3.2.1]oct-3α-yl ester;rel-(1R,3r,5S)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl 3-hydroxy-2-(hydroxymethyl)-2-phenylpropanoate
CBNumber: CB02193966
Molecular Formula: C18H25NO4
Formula Weight: 319.4
MOL File: 2515-36-8.mol

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

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
pka: 13.14±0.10(Predicted)

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Hazard and Precautionary Statements (GHS)

Symbol(GHS)

Signal word

Danger

Hazard statements

H302Harmful if swallowed

H311Toxic in contact with skin

H315Causes skin irritation

H319Causes serious eye irritation

H330Fatal if inhaled

H335May cause respiratory irritation

Precautionary statements

P260Do not breathe dust/fume/gas/mist/vapours/spray.

P264Wash hands thoroughly after handling.

P264Wash skin thouroughly after handling.

P270Do not eat, drink or smoke when using this product.

P271Use only outdoors or in a well-ventilated area.

P280Wear protective gloves/protective clothing/eye protection/face protection.

P284Wear respiratory protection.

P301+P312IF SWALLOWED: call a POISON CENTER or doctor/physician IF you feel unwell.

P302+P352IF ON SKIN: wash with plenty of soap and water.

P304+P340IF INHALED: Remove victim to fresh air and Keep at rest in a position comfortable for breathing.

P305+P351+P338IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.

P310Immediately call a POISON CENTER or doctor/physician.

P320Specific treatment is urgent (see … on this label).

P330Rinse mouth.

P332+P313IF SKIN irritation occurs: Get medical advice/attention.

P337+P313IF eye irritation persists: Get medical advice/attention.

P403+P233Store in a well-ventilated place. Keep container tightly closed.

P405Store locked up.

P501Dispose of contents/container to..…

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N-Bromosuccinimide Price

Cayman Chemical

Product number: 24266
Product name: α-Hydroxymethyl Atropine
Purity: ≥98%
Packaging: 25mg
Price: $87
Updated: 2024/03/01

Cayman Chemical

Product number: 24266
Product name: α-Hydroxymethyl Atropine
Purity: ≥98%
Packaging: 50mg
Price: $155
Updated: 2023/01/06

TRC

Product number: H946400
Product name: α-HydroxymethylAtropine
Packaging: 50mg
Price: $140
Updated: 2021/12/16

American Custom Chemicals Corporation

Product number: CCH0039214
Product name: OXYMETHYLATROPINE
Purity: 95.00%
Packaging: 5MG
Price: $501.66
Updated: 2021/12/16

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

Description

α-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.

Uses

Byproduct 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

Raw materials

Preparation Products

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

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2515-36-8, α,α-Bis(hydroxymethyl)benzeneacetic acid (1R,5S)-8-methyl-8-azabicyclo[3.2.1]oct-3α-yl esterRelated Search:

2-Hydroxyisobutyric acid ALPHA-HYDROXY-GAMMA-BUTYROLACTONE ALPHA-HYDROXYHIPPURIC ACID

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

2515-36-8

Aromatics, Heterocycles, Pharmaceuticals, Intermediates & Fine Chemicals