Trimethyldiphenylpropylamine

Base Information

• Chemical Name: Trimethyldiphenylpropylamine
• CAS No.: 13957-55-6
• Molecular Formula: C18H23N
• Molecular Weight: 253.38192
• Hs Code.: 2921499090
• UNII: P4X899446U
• DSSTox Substance ID: DTXSID801043073
• Nikkaji Number: J111.362C
• Wikipedia: Trimethyldiphenylpropylamine
• Wikidata: Q7842210
• Metabolomics Workbench ID: 154178
• ChEMBL ID: CHEMBL3707363
• Mol file: 13957-55-6.mol

Synonyms:Trimethyldiphenylpropylamine;13957-55-6;N,N,1-Trimethyl-3,3-diphenylpropylamine;N,N-dimethyl-4,4-diphenylbutan-2-amine;UNII-P4X899446U;Propylamine, N,N,1-trimethyl-3,3-diphenyl-;P4X899446U;Benzenepropanamine, N,N,alpha-trimethyl-gamma-phenyl-;Benzenepropanamine, N,N,.alpha.-trimethyl-.gamma.-phenyl-;N,N-Dimethyl-4,4-diphenyl-2-butanamine;N,N,alpha-Trimethyl-gamma-phenylbenzenepropan-1-amine;N,N-Dimethyl-(3,3-diphenyl-1-methylpropyl)amine;Recipavrin (Salt/Mix);Recipavrine (Salt/Mix);SCHEMBL25589;CHEMBL3707363;CHEBI:136024;DTXSID801043073;1,1-Diphenylbutane, 3-dimethylamino;DB13361;n,n-1-trimethyl-3,3-diphenylpropylamine;2-Butanamine, N,N-dimethyl, 4,4-diphenyl;LS-125681;LS-125682;N,-imethyl-(3,3-iphenyl-1-ethylpropyl)mine;N,N-dimethyl-3,3-diphenyl-1-methylpropylamine;Q7842210;N,N,.alpha.Trimethyl-.gamma.-phenylbenzenepropanamine;N,N-1-TRIMETHYL-3,3-DIPHENYLPROPYLAMINE [MI]

Chemical Property of Trimethyldiphenylpropylamine

Chemical Property:

• Vapor Pressure: 4.11E-05mmHg at 25°C
• Boiling Point: 351.4°C at 760 mmHg
• Flash Point: 150.4°C
• PSA: 3.24000
• Density: 0.975g/cm³
• LogP: 4.15870
• Storage Temp.: Refrigerator
• Solubility.: Chloroform, Dichloromethane, Ethyacetate
• XLogP3: 4.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 5
• Exact Mass: 253.183049738
• Heavy Atom Count: 19
• Complexity: 218

Purity/Quality:

99% ^*data from raw suppliers

N,N,1-Trimethyl-3,3-diphenylpropylamine ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(CC(C1=CC=CC=C1)C2=CC=CC=C2)N(C)C
• Uses: N,N,1-Trimethyl-3,3-diphenylpropylamine is an intermediate in the synthesis of Emepronium Bromide which is an antispasmodic. Used in treatment of urinary incontinence. Anticholinergic overactive bladder.

Technology Process of Trimethyldiphenylpropylamine

There total 16 articles about Trimethyldiphenylpropylamine 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:

(R,S)-2,2-diphenyl-4-dimethylaminopentanenitrile (125-79-1) → recipavrin (13957-55-6)

Guidance literature:

With sodium amide; benzene;

Reference yield:

→ recipavrin (13957-55-6)

Guidance literature:

With potassium hydroxide; 2,2'-[1,2-ethanediylbis(oxy)]bisethanol; at 220 ℃;

DOI:10.1021/jo01161a023

Reference yield:

4,4-diphenylbutan-2-one (5409-60-9) + dimethyl amine (124-40-3) → recipavrin (13957-55-6)

Guidance literature:

With ethanol; nickel; at 125 ℃; under 36775.4 Torr; Hydrogenation;

upstream raw materials:

(+/-)-4-Dimethylamino-2,2-diphenylpentanoic acid

(R,S)-2,2-diphenyl-4-dimethylaminopentanenitrile

dimethyl-(1-methyl-3,3-diphenyl-allyl)-amine

(+/-)-dimethyl-(1-methyl-3,3-diphenyl-allyl)-amine

Downstream raw materials:

trimethyl-(1-methyl-3,3-diphenyl-propyl)-ammonium; iodide