Atropine methylbromide

Base Information

• Chemical Name: Atropine methylbromide
• CAS No.: 2870-71-5
• Molecular Formula: C18H26 N O3 . Br
• Molecular Weight: 384.313
• European Community (EC) Number: 220-700-1
• UNII: 63IFT0IX9N
• DSSTox Substance ID: DTXSID2045103
• Wikidata: Q27263618
• ChEMBL ID: CHEMBL2146143
• Mol file: 2870-71-5.mol

Synonyms:8-methylatropinium nitrate;atropine iodomethylate;atropine methonitrate;atropine methylbromide;methyl atropine;methylatropine;methylatropine bromide;methylatropine iodide;methylatropine iodide, (endo-(+-))-isomer;methylatropine iodide, (endo-3(R))-isomer;methylatropine iodide, (endo-3(S))-isomer;methylatropine iodide, 3H-labeled, (endo-(+-))-isomer;methylatropine nitrate;methylatropine nitrate, (endo-(+-))-isomer;methylatropine nitrite, (endo-(+-))-isomer;methylatropine sulfate (2:1), (endo-(+-))-isomer;methylatropine, endo-3(R)-isomer;methylatropine, endo-3(S)-isomer;N-methylatropine

Chemical Property of Atropine methylbromide

Chemical Property:

• Melting Point: 222-223°
• Boiling Point: °Cat760mmHg
• Flash Point: °C
• Density: g/cm³
• Storage Temp.: Hygroscopic, -20°C Freezer, Under inert atmosphere
• Solubility.: DMSO (Slightly), Methanol (Slightly), Water (Slightly)
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 5
• Exact Mass: 383.10961
• Heavy Atom Count: 23
• Complexity: 387

Purity/Quality:

95-99% ^*data from raw suppliers

DL-Scopolamine Hydrobromide ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xn,N
• Hazard Codes: Xn,N
• Statements: 22-50/53
• Safety Statements: 36-60-61

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C[N+]1(C2CCC1CC(C2)OC(=O)C(CO)C3=CC=CC=C3)C.[Br-]
• Isomeric SMILES: C[N+]1([C@@H]2CC[C@H]1CC(C2)OC(=O)C(CO)C3=CC=CC=C3)C.[Br-]
• Uses: N-Methylatropine Bromide is used in the inhibition of prostaglandin EP2 receptor accelerating functional recovery after neurodegeneration and brain inflammation.

Technology Process of Atropine methylbromide

There total 1 articles about Atropine methylbromide which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

methyl bromide (74-83-9) + atropine (51-55-8) → N-Methylatropine bromide (2870-71-5)

Guidance literature:

With chloroform;

Reference yield:

N-Methylatropine bromide (2870-71-5) → C18H26NO3(1+)*Br(1-) + N-methylatropinium bromide (74347-29-8)

Guidance literature:

With β?cyclodextrin sulfonic acid; In aq. phosphate buffer; at 25 ℃; pH=3; pH-value; Reagent/catalyst; Resolution of racemate;

DOI:10.1002/chir.22731

upstream raw materials:

methyl bromide

atropine

Downstream raw materials:

N-methylatropinium bromide