1-Methyl-3-phenylpropylamine hydrochloride

Base Information

• Chemical Name: 1-Methyl-3-phenylpropylamine hydrochloride
• CAS No.: 73839-93-7
• Molecular Formula: C10H15N.ClH
• Molecular Weight: 185.697
• Hs Code.: 2921499090
• European Community (EC) Number: 635-275-1
• NSC Number: 163925
• Mol file: 73839-93-7.mol

Synonyms:1-Methyl-3-phenylpropylamine hydrochloride;73839-93-7;4-Phenyl-2-butylamine hydrochloride;NSC 163925;2-Butylamine, 4-phenyl-, hydrochloride;Propylamine, 1-methyl-3-phenyl-, hydrochloride;Benzenepropanamine, alpha-methyl-, hydrochloride;alpha-methyl-benzenepropanamine;4-phenylbutan-2-amine hydrochloride;C(CC(C)N)c1ccccc1;2-Butylamine, hydrochloride;WLN: ZY1&2R &GH;SCHEMBL4752502;4-phenylbutan-2-aminehydrochloride;NSC163925;AKOS024323108;NSC-163925;LS-125719;Benzenepropanamine, .alpha.-methyl-, hydrochloride

Chemical Property of 1-Methyl-3-phenylpropylamine hydrochloride

Chemical Property:

• PSA: 26.02000
• LogP: 3.46870
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 3
• Exact Mass: 185.0971272
• Heavy Atom Count: 12
• Complexity: 95

Purity/Quality:

99%min ^*data from raw suppliers

4-phenylbutan-2-aminehydrochloride ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: CC(CCC1=CC=CC=C1)N.Cl

Technology Process of 1-Methyl-3-phenylpropylamine hydrochloride

There total 4 articles about 1-Methyl-3-phenylpropylamine hydrochloride 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: 80.0%

N-(4-methoxyphenyl)-4-phenyl-2-butylamine (324025-11-8) → 1-methyl-3-phenylpropylamine hydrochloride (73839-93-7)

Guidance literature:

With sulfuric acid; periodic acid; In acetonitrile; at 21 ℃; for 16h;

DOI:10.1016/j.tetlet.2006.09.044

Reference yield: 51.0%

N-(3-phenyl-1-methylpropyl)-N'-(tert-butoxycarbonyl)hydrazinecarboxylic acid tert-butyl ester (704900-21-0) → 1-methyl-3-phenylpropylamine hydrochloride (73839-93-7)

Guidance literature:

N-(3-phenyl-1-methylpropyl)-N'-(tert-butoxycarbonyl)hydrazinecarboxylic acid tert-butyl ester; In acetic acid; at 110 ℃; for 12h;

With hydrogenchloride; acetone; zinc; In acetic acid; for 8h;

DOI:10.1021/ja062355+

Reference yield:

4-Phenylbut-1-ene (768-56-9) → 1-methyl-3-phenylpropylamine hydrochloride (73839-93-7)

Guidance literature:

Multi-step reaction with 2 steps

1.1: 94 percent / phenylsilane / Co(C₁₅H₁₉N₂O₅)*MeOH / ethanol / 23 °C

2.1: acetic acid / 12 h / 110 °C

2.2: 51 percent / acetone; zinc; aq. HCl / acetic acid / 8 h

With phenylsilane; Co(C₁₅H₁₉N₂O₅)*MeOH; In ethanol; acetic acid;

DOI:10.1021/ja062355+

upstream raw materials:

N-(3-phenyl-1-methylpropyl)-N'-(tert-butoxycarbonyl)hydrazinecarboxylic acid tert-butyl ester

N-(4-methoxyphenyl)-4-phenyl-2-butylamine

4-Phenylbut-1-ene

(RS)-1-methyl-3-phenylpropylamine

Downstream raw materials:

(S)-2,2,2-trifluoro-N-(4-phenylbutan-2-yl)acetamide

(RS)-1-methyl-3-phenylpropylamine

(S)-α-methylbenzenepropanamine hydrochloride

(+)-(R)-α-methylbenzenepropanamine hydrochloride

Refernces

• 1、 Waser, Jerome,Gaspar, Boris,Nambu, Hisanori,Carreira, Erick M.. "Hydrazines and azides via the metal-catalyzed hydrohydrazination and hydroazidation of olefins". . p. 11693 - 11712. Retrieved 2007/10/03.