(4-Thien-3-ylphenyl)methylamine

Base Information

• Chemical Name: (4-Thien-3-ylphenyl)methylamine
• CAS No.: 876317-18-9
• Molecular Formula: C11H11 N S
• Molecular Weight: 189.281
• Hs Code.: 2934999090
• DSSTox Substance ID: DTXSID30594583
• Wikidata: Q82489471
• Mol file: 876317-18-9.mol

Synonyms:876317-18-9;(4-thien-3-ylphenyl)methylamine;(4-thiophen-3-ylphenyl)methanamine;(4-(Thiophen-3-yl)phenyl)methanamine;[4-(thiophen-3-yl)phenyl]methanamine;1-[4-(Thiophen-3-yl)phenyl]methanamine;Benzenemethanamine, 4-(3-thienyl)-;Benzenemethanamine,4-(3-thienyl)-;SCHEMBL112385;4-(Thiophen-3-yl)benzylamine;DTXSID30594583;QTXFTOUAVPVJMZ-UHFFFAOYSA-N;[4-(3-thiophenyl)phenyl]methanamine;AKOS006345244;MS-22421;CS-0021997;EN300-234864;A805734;F2167-0748

Chemical Property of (4-Thien-3-ylphenyl)methylamine

Chemical Property:

• Vapor Pressure: 0.00135mmHg at 25°C
• Melting Point: 115.5-117
• Boiling Point: 297.4°C at 760 mmHg
• Flash Point: 133.7°C
• PSA: 54.26000
• Density: 1.152g/cm³
• LogP: 3.57410
• Sensitive.: Air Sensitive
• XLogP3: 2.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 189.06122053
• Heavy Atom Count: 13
• Complexity: 152

Purity/Quality:

98%min ^*data from raw suppliers

[4-(thiophen-3-yl)phenyl]methanamine ^*data from reagent suppliers

Safty Information:

• Hazard Codes: T

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=CC=C1CN)C2=CSC=C2

Technology Process of (4-Thien-3-ylphenyl)methylamine

There total 2 articles about (4-Thien-3-ylphenyl)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: 58.0%

Thien-3-ylboronic acid (6165-69-1) + 4-Bromobenzylamine (3959-07-7) → (4-(thiophen-3-yl)phenyl)methanamine (876317-18-9)

Guidance literature:

With bis-triphenylphosphine-palladium(II) chloride; potassium carbonate; In water; at 20 - 100 ℃; for 1.5h; Sealed tube; Inert atmosphere; Microwave irradiation;

DOI:10.1016/j.ejmech.2014.09.062

Reference yield:

→ (4-(thiophen-3-yl)phenyl)methanamine (876317-18-9)

Guidance literature:

Reference yield: 78.0%

N1,N6-bis(4-fluorophenyl)-5,10-dioxo-5,10-dihydrodiimidazo[1,5-a:1',5'-d]pyrazine-1,6-dicarboxamide + (4-(thiophen-3-yl)phenyl)methanamine (876317-18-9) → N5-(4-fluorophenyl)-N4-(4-(thiophen-3-yl)benzyl)-1H-imidazole-4,5-dicarboxamide

Guidance literature:

With N-ethyl-N,N-diisopropylamine; In dichloromethane; Inert atmosphere; Reflux;

DOI:10.1016/j.ejmech.2014.09.062

upstream raw materials:

Thien-3-ylboronic acid

4-Bromobenzylamine

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