Mebeverine hydrochloride

Base Information

• Chemical Name: Mebeverine hydrochloride
• CAS No.: 2753-45-9
• Molecular Formula: C25H35NO5^.HCl
• Molecular Weight: 429.55
• Mol file: 2753-45-9.mol

Synonyms:Benzoicacid, 3,4-dimethoxy-, 4-[ethyl[2-(4-methoxyphenyl)-1-methylethyl]amino]butylester, hydrochloride (9CI);Veratric acid, 4-[ethyl(p-methoxy-a-methylphenethyl)amino]-, butylester, hydrochloride (6CI,7CI,8CI);1-Butanol, 4-[ethyl(p-methoxy-a-methylphenethyl)amino]-,veratrate, hydrochloride (8CI);4-[Ethyl(p-methoxy-a-methylphenethyl)amino]butyl veratrate hydrochloride;4'-[N-Ethyl-1''-methyl-2''-(4'''-methoxyphenyl)ethylamino]butyl3,4-dimethoxybenzoate hydrochloride;CSAG 144;Colaspa;Colofac;Colospasmin;Duspatal;Duspatalin;Mebaspa;NSC 169101;

Chemical Property of Mebeverine hydrochloride

Chemical Property:

• Vapor Pressure: 6.92E-12mmHg at 25°C
• Melting Point: 105-107 C
• Boiling Point: 543.8 °C at 760 mmHg
• PKA: pKa 9.07± 0.02(40% EtOH,t =25,) (Uncertain)
• Flash Point: 282.7 °C
• PSA: 57.23000
• LogP: 5.40450
• Storage Temp.: 2-8°C
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 14
• Exact Mass: 465.2282009
• Heavy Atom Count: 32
• Complexity: 494

Purity/Quality:

Mebeverine hydrochloride ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xn, Xi
• Hazard Codes: Xn,Xi
• Statements: 22-36/37/38
• Safety Statements: 36-26

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: [H+].CCN(CCCCOC(=O)C1=CC(=C(C=C1)OC)OC)C(C)CC2=CC=C(C=C2)OC.[Cl-]
• Uses: muscarinic ACh agonist, antiglaucoma Smooth muscle relaxant. Antispasmodic.
• Therapeutic Function: Spasmolytic