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62-51-1

62-51-1 structural image
Product Name: METHACHOLINE CHLORIDE
Formula: C8H18ClNO2
Synonyms: (2-Acetoxypropyl)trimethylammonium chloride;Acetyl-β-methylcholine chloride;Methacholine chloride
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CHEMICAL AND PHYSICAL PROPERTIES

Solubility >29.4 [ug/mL] (The mean of the results at pH 7.4)
Collision Cross Section 134.8 Ų [M+H]+ [CCS Type: TW, Method: calibrated with polyalanine and drug standards]

SAFETY INFORMATION

Signal word Warning
Pictogram(s)

Exclamation Mark
Irritant
GHS07
GHS Hazard Statements H302:Acute toxicity,oral
H315:Skin corrosion/irritation
H319:Serious eye damage/eye irritation
H335:Specific target organ toxicity, single exposure;Respiratory tract irritation
Precautionary Statement Codes P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.

COMPUTED DESCRIPTORS

Molecular Weight 195.69 g/mol
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 4
Exact Mass 195.1026065 g/mol
Monoisotopic Mass 195.1026065 g/mol
Topological Polar Surface Area 26.3 Ų
Heavy Atom Count 12
Formal Charge 0
Complexity 138
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 2
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

Methacholine chloride is a quaternary ammonium salt. It contains a methacholine.