3-Ethyl-4-[(1-methyl-5-imidazolyl)methyl]tetrahydrofuran-2-one Hydrochloride

Base Information

• Chemical Name: 3-Ethyl-4-[(1-methyl-5-imidazolyl)methyl]tetrahydrofuran-2-one Hydrochloride
• CAS No.: 28958-85-2
• Molecular Formula: C11H16 N2 O2 . Cl H
• Molecular Weight: 244.7179
• NSC Number: 117178
• Mol file: 28958-85-2.mol

Synonyms:Amistura P;NSC-117178;Isopilocarpine, hydrochloride;NSC117178;LS-13991;FT-0631237;P0434;2(3H)-Furanone, monohydrochloride, (3R-trans)-;3-Ethyl-4-[(1-methyl-5-imidazolyl)methyl]tetrahydrofuran-2-one Hydrochloride

Chemical Property of 3-Ethyl-4-[(1-methyl-5-imidazolyl)methyl]tetrahydrofuran-2-one Hydrochloride

Chemical Property:

• Vapor Pressure: 1.16E-07mmHg at 25°C
• Melting Point: 147-149°C
• Boiling Point: 431.8°C at 760 mmHg
• Flash Point: 215°C
• PSA: 44.12000
• LogP: 1.96380
• Storage Temp.: Hygroscopic, Refrigerator, under inert atmosphere
• Solubility.: Methanol (Slightly), Water (Slightly, Sonicated)
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 244.0978555
• Heavy Atom Count: 16
• Complexity: 245

Purity/Quality:

99% ^*data from raw suppliers

IsopilocarpineHydrochloride ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC1C(COC1=O)CC2=CN=CN2C.Cl
• Uses: An isomeric degradation product of Pilocarpine (P441500) with significantly lower binding affinity to muscarinic cholinergic receptors (～0.1 that of Pilocarpine).