Methyl cis-(+)-3-methyl-1-phenethyl-4-(phenylamino)piperidine-4-carboxylate

Base Information

• Chemical Name: Methyl cis-(+)-3-methyl-1-phenethyl-4-(phenylamino)piperidine-4-carboxylate
• CAS No.: 61380-35-6
• Molecular Formula: C₂₂H₂₈N₂O₂
• Molecular Weight: 352.477
• European Community (EC) Number: 262-749-1
• DSSTox Substance ID: DTXSID40210303
• Wikidata: Q83084971
• Mol file: 61380-35-6.mol

Synonyms:61380-35-6;Methyl cis-(+)-3-methyl-1-phenethyl-4-(phenylamino)piperidine-4-carboxylate;EINECS 262-749-1;methyl (3S,4S)-4-anilino-3-methyl-1-(2-phenylethyl)piperidine-4-carboxylate;cis-(+)-3-Methyl-4-(phenylamino)-1-(2-phenylethyl)-4-piperidinecarboxylic Acid Methyl Ester;SCHEMBL11563701;DTXSID40210303;ULCFSXQHBSJRKV-AVRDEDQJSA-N

Chemical Property of Methyl cis-(+)-3-methyl-1-phenethyl-4-(phenylamino)piperidine-4-carboxylate

Chemical Property:

• Vapor Pressure: 3.4E-09mmHg at 25°C
• Boiling Point: 475.2°C at 760 mmHg
• Flash Point: 241.2°C
• PSA: 41.57000
• Density: 1.112g/cm³
• LogP: 3.60570
• XLogP3: 4.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 7
• Exact Mass: 352.215078140
• Heavy Atom Count: 26
• Complexity: 443

Purity/Quality:

99% ^*data from raw suppliers

cis-(+)-3-Methyl-4-(phenylamino)-1-(2-phenylethyl)-4-piperidinecarboxylicAcidMethylEster ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1CN(CCC1(C(=O)OC)NC2=CC=CC=C2)CCC3=CC=CC=C3
• Isomeric SMILES: C[C@H]1CN(CC[C@]1(C(=O)OC)NC2=CC=CC=C2)CCC3=CC=CC=C3

Technology Process of Methyl cis-(+)-3-methyl-1-phenethyl-4-(phenylamino)piperidine-4-carboxylate

There total 3 articles about Methyl cis-(+)-3-methyl-1-phenethyl-4-(phenylamino)piperidine-4-carboxylate 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:

→ (3S,4R)-3-Methyl-1-phenethyl-4-phenylamino-piperidine-4-carboxylic acid methyl ester (61085-95-8,61085-96-9,61380-35-6,61380-36-7,73025-38-4,73025-42-0)

Guidance literature:

Carbonsaeure 10b-Na-Salz, MeI;

Reference yield:

→ cis-3-Methyl-4-anilino-1-(2-phenylethyl)-piperidin-4-carbonsaeure-methylester (61085-95-8,61085-96-9,61380-35-6,61380-36-7,73025-38-4,73025-42-0)

Guidance literature:

4-Carboxamid, 1.) KOH, Ethylenglykol, 2.) HCl, 3.) NaOH, 4.) MeI, HMPT;

Reference yield:

→ (3R,4R)-3-Methyl-1-phenethyl-4-phenylamino-piperidine-4-carboxylic acid methyl ester (61085-95-8,61085-96-9,61380-35-6,61380-36-7,73025-38-4,73025-42-0)

Guidance literature:

Carbonsaeure 10a-Na-Salz, MeI;