Methylergonovine maleate salt

Base Information

• Chemical Name: Methylergonovine maleate salt
• CAS No.: 57432-61-8
• Molecular Formula: C20H25N3O2^.C4H4O4
• Molecular Weight: 455.511
• Hs Code.: 2939690000
• European Community (EC) Number: 260-734-4
• Mol file: 57432-61-8.mol

Synonyms:Methergine;Ergoline-8-carboxamide,9,10-didehydro-N- [(1S)-1-(hydroxymethyl)propyl]-6-methyl-,(8a)-,(2Z)-2-butenedioate (1:1) (salt);Methylergometrine maleate (JP14);Methylergometrine maleate;Methylergonovine maleate;Methylergonovine maleate (USP);Methergine (TN);Erezin;METHYL ERGOMETRINE MALEATE;METHYLERGONOVINE MALEATE;METHYLERGOBASINE MALEATE;USAF UCTL-8;METHEGRIN;MALEIC ACID, METHYL ERGONOVINE;

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Chemical Property of Methylergonovine maleate salt

Chemical Property:

• Vapor Pressure: 3.51E-28mmHg at 25°C
• Melting Point: 1720C (dec)
• Refractive Index: 1.6500 (estimate)
• Boiling Point: 638.4°Cat760mmHg
• Flash Point: 339.9°C
• PSA: 142.96000
• Density: g/cm³
• LogP: 1.96530
• Storage Temp.: -20°C Freezer
• Solubility.: H2O: 25 mg/mL
• Hydrogen Bond Donor Count: 5
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 6
• Exact Mass: 455.20563565
• Heavy Atom Count: 33
• Complexity: 668

Purity/Quality:

Safty Information:

• Hazard Codes: T
• Statements: 23/24/25-62
• Safety Statements: 36/37/39-45

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: CCC(CO)NC(=O)C1CN(C2CC3=CNC4=CC=CC(=C34)C2=C1)C.C(=CC(=O)O)C(=O)O
• Isomeric SMILES: CC[C@@H](CO)NC(=O)[C@H]1CN([C@@H]2CC3=CNC4=CC=CC(=C34)C2=C1)C.C(=CC(=O)O)C(=O)O
• Uses: A metabolite of Methysergide. Semisynthetic ergot alkaloid. Oxytocic

Technology Process of Methylergonovine maleate salt

There total 1 articles about Methylergonovine maleate salt 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:

→ methylergometrine maleate (57432-61-8)

Guidance literature:

Saeure-hydrochlorid (III), L-(+)-C2H5-CH(NH2)-CO2CH3, NaOH, NaBH4;