Cantharidin methylimide

Base Information

• Chemical Name: Cantharidin methylimide
• CAS No.: 76970-78-0
• Molecular Formula: C₁₁H₁₅NO₃
• Molecular Weight: 209.245
• UNII: 62T9S2Y75E
• NCI Thesaurus Code: C173446
• ChEMBL ID: CHEMBL5218531
• Mol file: 76970-78-0.mol

Synonyms:cantharidin methylimide;hexahydro-2,3a,7a-trimethyl-4,7-epoxy-1H-isoindole-1,3(2H)-dione;hexahydro-2,3a,7a-trimethyl-4,7-epoxy-1H-isoindole-1,3(2H)-dione, (4beta)-isomer;N-methylcantharidimide

Chemical Property of Cantharidin methylimide

Chemical Property:

• Vapor Pressure: 0.000181mmHg at 25°C
• Boiling Point: 329.2°C at 760 mmHg
• Flash Point: 152.9°C
• PSA: 46.61000
• Density: 1.275g/cm³
• LogP: 0.49670
• XLogP3: 0.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 0
• Exact Mass: 209.10519334
• Heavy Atom Count: 15
• Complexity: 346

Purity/Quality:

99% ^*data from raw suppliers

Methylcantharidimide ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC12C3CCC(C1(C(=O)N(C2=O)C)C)O3
• Isomeric SMILES: C[C@@]12[C@H]3CC[C@@H]([C@@]1(C(=O)N(C2=O)C)C)O3

Technology Process of Cantharidin methylimide

There total 4 articles about Cantharidin methylimide 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:

→ 2,3a,7a-trimethyl-hexahydro-4,7-epoxido-isoindole-1,3-dione (76970-78-0,80226-94-4,946517-54-0)

Guidance literature:

With ammonium hydroxide; at 200 ℃; im Rohr;

Reference yield:

methyl iodide (74-88-4) → 2,3a,7a-trimethyl-hexahydro-4,7-epoxido-isoindole-1,3-dione (76970-78-0,80226-94-4,946517-54-0)

Guidance literature:

With methanol; sodium carbonate; at 100 ℃; im Rohr;

Reference yield:

methylamine (74-89-5) + cantharidin (56-25-7) → 2,3a,7a-trimethyl-hexahydro-4,7-epoxido-isoindole-1,3-dione (76970-78-0,80226-94-4,946517-54-0)

Guidance literature:

With methanol; at 140 - 145 ℃; im Rohr;

upstream raw materials:

methylamine

cantharidin

methyl iodide