(1-Phenylcyclobutyl)methylamine

Base Information

• Chemical Name: (1-Phenylcyclobutyl)methylamine
• CAS No.: 91245-59-9
• Molecular Formula: C11H15 N
• Molecular Weight: 161.247
• European Community (EC) Number: 830-884-0
• DSSTox Substance ID: DTXSID00575723
• Wikidata: Q82465142
• Mol file: 91245-59-9.mol

Synonyms:(1-phenylcyclobutyl)methylamine;91245-59-9;(1-phenylcyclobutyl)methanamine;C-(1-Phenyl-cyclobutyl)-methylamine;1-Phenylcyclobutanemethanamine;MFCD06213096;SCHEMBL294970;DTXSID00575723;AUOZFCSMXYBIQW-UHFFFAOYSA-N;1-PHENYL-CYCLOBUTANEMETHYLAMINE;AKOS000303328;AB23383;1-(1-PHENYLCYCLOBUTYL)METHANAMINE;SY168259;TS-02153;(1-Phenylcyclobutyl)methylamine, AldrichCPR;CS-0056584;EN300-25683;P10345;A917055;J-500256;Z212171864

Chemical Property of (1-Phenylcyclobutyl)methylamine

Chemical Property:

• Vapor Pressure: 0.015mmHg at 25°C
• Refractive Index: 1.558
• Boiling Point: 256.7°Cat760mmHg
• PKA: 10.27±0.29(Predicted)
• Flash Point: 107.7°C
• PSA: 26.02000
• Density: 1.018g/cm³
• LogP: 2.76730
• XLogP3: 2.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 161.120449483
• Heavy Atom Count: 12
• Complexity: 143

Purity/Quality:

98%min ^*data from raw suppliers

C-(1-Phenyl-cyclobutyl)-methylamine ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1CC(C1)(CN)C2=CC=CC=C2

Technology Process of (1-Phenylcyclobutyl)methylamine

There total 2 articles about (1-Phenylcyclobutyl)methylamine 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: 81.3%

1-phenylcyclobutanecarbonitrile (14377-68-5) → (1-phenylcyclobutyl)-methanamine (91245-59-9)

Guidance literature:

With sodium hydroxide; LiAlH₄; In tetrahydrofuran; toluene-THF; water;

Reference yield: 53.0%

1-phenylcyclobutylmethylaminocarbonitrile → (1-phenylcyclobutyl)-methanamine (91245-59-9)

Guidance literature:

With sodium hydroxide; In tetrahydrofuran; methanol; dichloromethane;

Reference yield:

(1-phenylcyclobutyl)-methanamine (91245-59-9) + methyl chloroformate (79-22-1) → (1-Phenyl-cyclobutylmethyl)-carbamic acid methyl ester (850875-63-7)

Guidance literature:

With triethylamine; In tetrahydrofuran; at 20 ℃; for 15h;

upstream raw materials:

1-phenylcyclobutanecarbonitrile

Downstream raw materials:

(4β,5α)-12-Hydroxy-N-[(1-phenylcyclobutyl)methyl]podocarpa-8,11,13-trien-16-amide

(1-Phenyl-cyclobutylmethyl)-carbamic acid methyl ester

4,4-siprocyclobutyl-1,2,3,4-tetrahydro-isoquinoline

Refernces

• 1、 -. "Therapeutic compounds for treating dyslipidemic conditions". . . Retrieved 2008/06/13.
• 2、 -. "Substituted sulfonamides, process of preparation and medicines containing same". . . Retrieved 2008/06/13.