(4'-Fluoro[1,1'-biphenyl]-2-YL)methanamine

Base Information

• Chemical Name: (4'-Fluoro[1,1'-biphenyl]-2-YL)methanamine
• CAS No.: 884504-18-1
• Molecular Formula: C₁₃H₁₂FN
• Molecular Weight: 201.243
• DSSTox Substance ID: DTXSID60396178
• Wikidata: Q72479417
• Mol file: 884504-18-1.mol

Synonyms:884504-18-1;(4'-FLUORO[1,1'-BIPHENYL]-2-YL)METHANAMINE;[2-(4-fluorophenyl)phenyl]methanamine;(4'-Fluoro-[1,1'-biphenyl]-2-yl)methanamine;4'-Fluorobiphenyl-2-methylamine;4'-Fluoro-2-biphenylmethylamine;1-(4'-Fluorobiphenyl-2-yl)MethanaMine;4-(2-(aMinoMethyl)phenyl)-1-fluorobenzene;[1,1'-Biphenyl]-2-methanamine,4'-fluoro-;[1,1'-Biphenyl]-2-methanamine, 4'-fluoro-;SCHEMBL3723618;DTXSID60396178;2-(Aminomethyl)-4'-fluorobiphenyl;MFCD05864430;AKOS002683456;SB77565;1-(4'-fluorobiphenyl-2-yl)methanamine;NCGC00373881-01;(4'-fluoro-1,1'-biphenyl-2-yl)methanamine;AM20041303;BB 0262830;CS-0313834;FT-0686927;(4'-Fluorobiphenyl-2-yl)methanamine, AldrichCPR;1-(4'-Fluoro[1,1'-biphenyl]-2-yl)methanamine;A847793;Q-103433

Chemical Property of (4'-Fluoro[1,1'-biphenyl]-2-YL)methanamine

Chemical Property:

• Boiling Point: 334.6 °C at 760 mmHg
• Flash Point: 166.7 °C
• PSA: 26.02000
• Density: 1.124g/cm³
• LogP: 3.65170
• Sensitive.: Air Sensitive
• XLogP3: 2.5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 201.095377549
• Heavy Atom Count: 15
• Complexity: 187

Purity/Quality:

97% ^*data from raw suppliers

(4'-Fluoro[1,1'-biphenyl]-2-yl)methanamine ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi,T
• Statements: 25
• Safety Statements: 45

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C(=C1)CN)C2=CC=C(C=C2)F

Technology Process of (4'-Fluoro[1,1'-biphenyl]-2-YL)methanamine

There total 6 articles about (4'-Fluoro[1,1'-biphenyl]-2-YL)methanamine 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:

4'-fluoro-[1,1'-biphenyl]-2-carbonitrile (89346-55-4) → (4'-fluorobiphenyl-2-yl)methanamine (884504-18-1)

Guidance literature:

With aluminum (III) chloride; lithium aluminium tetrahydride; In tetrahydrofuran; at 0 - 20 ℃; for 2h; Inert atmosphere;

DOI:10.1016/j.bmc.2014.07.026

Reference yield:

1-(4'-fluorobiphenyl-2-yl)methanamine hydrochloride (1189729-43-8) → (4'-fluorobiphenyl-2-yl)methanamine (884504-18-1)

Guidance literature:

With methanol; ammonia; In n-heptane; dichloromethane;

Reference yield:

4-fluoroboronic acid (1765-93-1) + N-(tert-butoxycarbonyl)-2-bromobenzylamine (162356-90-3) → (4'-fluorobiphenyl-2-yl)methanamine (884504-18-1)

Guidance literature:

4-fluoroboronic acid; N-(tert-butoxycarbonyl)-2-bromobenzylamine; With tetrakis(triphenylphosphine) palladium⁽⁰⁾; caesium carbonate; In 1,2-dimethoxyethane; water; at 130 ℃; Microwave irradiation;

With hydrogenchloride; In ethyl acetate;

DOI:10.1016/j.bmcl.2016.02.081

upstream raw materials:

1-(4'-fluorobiphenyl-2-yl)methanamine hydrochloride

4'-fluoro-[1,1'-biphenyl]-2-carbonitrile

4-fluoroboronic acid

2-iodobenzonitrile

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