Diperodon

Base Information

• Chemical Name: Diperodon
• CAS No.: 101-08-6
• Molecular Formula: C22H27 N3 O4
• Molecular Weight: 397.474
• Hs Code.: 2933399090
• European Community (EC) Number: 202-913-1
• UNII: UIN4PYP84R
• DSSTox Substance ID: DTXSID1047865
• Nikkaji Number: J4.991C
• Wikidata: Q3708860
• NCI Thesaurus Code: C170537
• Metabolomics Workbench ID: 152689
• ChEMBL ID: CHEMBL338667
• Mol file: 101-08-6.mol

Synonyms:3-piperidino-1,2-propanediol dicarbanilate ester;diperodon;HCl of diperodon;monohydrate of diperodon

Chemical Property of Diperodon

Chemical Property:

• Vapor Pressure: 3.3E-10mmHg at 25°C
• Refractive Index: 1.6500 (estimate)
• Boiling Point: 502°Cat760mmHg
• PKA: pKa 8.44(H2O) (Occasionally)
• Flash Point: 257.4°C
• PSA: 79.90000
• Density: g/cm³
• LogP: 4.42220
• XLogP3: 3.7
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 9
• Exact Mass: 397.20015635
• Heavy Atom Count: 29
• Complexity: 498

Purity/Quality:

98%,99%, ^*data from raw suppliers

DIPERODON 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CCN(CC1)CC(COC(=O)NC2=CC=CC=C2)OC(=O)NC3=CC=CC=C3
• Therapeutic Function: 1,2-Propanediol, 3-(1-piperidinyl)-, bis(phenylcarbamate) (ester), hydrochloride

Technology Process of Diperodon

There total 3 articles about Diperodon 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:

phenyl isocyanate (103-71-9) → diperodon (101-08-6)

Guidance literature:

With benzene;

DOI:10.1002/ardp.19592920109

Reference yield:

phenyl isocyanate (103-71-9) → (+)-1,2-bis-phenylcarbamoyloxy-3-piperidino-propane (101-08-6,74664-38-3,102737-82-6)

Guidance literature:

With benzene;

DOI:10.1021/ja01257a031

Reference yield:

phenyl isocyanate (103-71-9) → (-)-1,2-bis-phenylcarbamoyloxy-3-piperidino-propane (101-08-6,74664-38-3,102737-82-6)

Guidance literature:

With benzene;

DOI:10.1021/ja01257a031

upstream raw materials:

phenyl isocyanate