N-Propylnorapomorphine

Base Information

• Chemical Name: N-Propylnorapomorphine
• CAS No.: 18426-20-5
• Deprecated CAS: 104056-65-7
• Molecular Formula: C₁₉H₂₁NO₂
• Molecular Weight: 295.381
• Hs Code.: 2933990090
• UNII: NH381P1BR8
• DSSTox Substance ID: DTXSID50939811
• Nikkaji Number: J261.846J
• Wikipedia: Propylnorapomorphine
• Wikidata: Q27088028
• Pharos Ligand ID: 7658QM65XGRK
• ChEMBL ID: CHEMBL225230
• Mol file: 18426-20-5.mol

Synonyms:(11C)MNPA;6-propylnorapomorphine;N-n-propylnorapomorphine;N-n-propylnorapomorphine, (+-)-isomer;N-n-propylnorapomorphine, (R)-isomer;N-n-propylnorapomorphine, hydrochloride, (+-)-isomer;N-n-propylnorapomorphine, hydrochloride, (R)-isomer;N-n-propylnorapomorphine, hydroiodide, (+-)-isomer;n-propylapomorphine;N-propylnorapomorphine;propyl-norapomorphine

Chemical Property of N-Propylnorapomorphine

Chemical Property:

• Vapor Pressure: 2.89E-10mmHg at 25°C
• Boiling Point: 491°Cat760mmHg
• Flash Point: 268°C
• PSA: 43.70000
• Density: 1.232g/cm³
• LogP: 3.56800
• Storage Temp.: 2-8°C
• Solubility.: 0.1 M HCl: 5-10 mg/mL Solutions should be freshly prepared
• XLogP3: 3.2
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 295.157228913
• Heavy Atom Count: 22
• Complexity: 401

Purity/Quality:

98%Min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: CCCN1CCC2=C3C1CC4=C(C3=CC=C2)C(=C(C=C4)O)O
• Isomeric SMILES: CCCN1CCC2=C3[C@H]1CC4=C(C3=CC=C2)C(=C(C=C4)O)O

Technology Process of N-Propylnorapomorphine

There total 2 articles about N-Propylnorapomorphine 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: 100.0%

(R)-MDO-NPA (81264-57-5) → N-propylnorapomorphine (18426-20-5,58479-52-0)

Guidance literature:

With boron trichloride; In dichloromethane;

DOI:10.1021/jo00326a058

Reference yield:

norapomorphine mesylate (1216940-66-7) + 1-iodo-propane (107-08-4) → N-propylnorapomorphine (18426-20-5,58479-52-0)

Guidance literature:

With sodium hydrogencarbonate; potassium iodide; In acetonitrile; for 24h; Reflux;

DOI:10.1016/j.tetlet.2009.12.103

Reference yield:

N-propylnorapomorphine (18426-20-5,58479-52-0) + phenylboronic acid (98-80-6) → C25H24BNO2

Guidance literature:

In ethyl acetate; at 70 ℃;

DOI:10.3390/molecules15042347

upstream raw materials:

(R)-MDO-NPA

norapomorphine mesylate

1-iodo-propane

Downstream raw materials:

(R)-MDO-NPA

Refernces

• 1、 Ram, Vishnu J.,Neumeyer, John L.. "Aporphines. 35. Synthesis of (R)-(-)- and (S)-(+)-Apomorphine from Thebaine and (+)-Bulbocapnine". . p. 2830 - 2831. Retrieved 2007/10/02.