3-(4-Bromophenyl)azetidine

Base Information

• Chemical Name: 3-(4-Bromophenyl)azetidine
• CAS No.: 7215-01-2
• Molecular Formula: C9H10BrN
• Molecular Weight: 212.089
• DSSTox Substance ID: DTXSID30222470
• Nikkaji Number: J84.665A
• Wikidata: Q83100700
• Mol file: 7215-01-2.mol

Synonyms:3-(4-bromophenyl)azetidine;7215-01-2;3-(p-Bromophenyl)azetidine;L 2421;AZETIDINE, 3-(p-BROMOPHENYL)-;MFCD01665286;BRN 1424810;SCHEMBL15301182;DTXSID30222470;JHJFWWNFVIMSMT-UHFFFAOYSA-N;GS0564;AKOS017398266;SB51445;LS-23057;PS-19097;SY019231;CS-0058165;FT-0663830;EN300-131404;L-2421;P10199;A936762

Chemical Property of 3-(4-Bromophenyl)azetidine

Chemical Property:

• Vapor Pressure: 0.00405mmHg at 25°C
• Boiling Point: 279.3°Cat760mmHg
• Flash Point: 122.7°C
• PSA: 12.03000
• Density: 1.439g/cm³
• LogP: 2.46470
• XLogP3: 2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 210.99966
• Heavy Atom Count: 11
• Complexity: 126

Purity/Quality:

99% ^*data from raw suppliers

3-(4-Bromophenyl)azetidine ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1C(CN1)C2=CC=C(C=C2)Br
• Uses: A 3-phenylazetidine derivative that showed slight sympathomimetic effects in animals during pharmacology studies. 3-(4-Bromophenyl)azetidine is a 3-phenylazetidine derivative that showed slight sympathomimetic effects in animals during pharmacology studies.

Technology Process of 3-(4-Bromophenyl)azetidine

There total 1 articles about 3-(4-Bromophenyl)azetidine 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: 97.7%

tert-butyl 3-(4-bromophenyl)azetidine-1-carboxylate (1203681-52-0) → 3-(4-bromophenyl)azetidine (7215-01-2)

Guidance literature:

With trifluoroacetic acid; In dichloromethane; at 0 - 20 ℃; for 1h;

Reference yield: 100.0%

3-(4-bromophenyl)azetidine (7215-01-2) + C14H15BClNO3 → 5-[4-(azetidin-3-yl)phenyl]-6-chloro-1H-indole-3-carbaldehyde (1467061-39-7)

Guidance literature:

With (1,1'-bis(diphenylphosphino)ferrocene)palladium(II) dichloride; potassium carbonate; In 1,4-dioxane; at 90 ℃; for 0.5h;

Reference yield: 86.0%

3-(4-bromophenyl)azetidine (7215-01-2) + methanesulfonyl chloride (124-63-0) → 3-(4-bromophenyl)-1-(methylsulfonyl)azetidine

Guidance literature:

With triethylamine; In dichloromethane; at 0 - 20 ℃; for 2h;

upstream raw materials:

tert-butyl 3-(4-bromophenyl)azetidine-1-carboxylate

Downstream raw materials:

5-[4-(azetidin-3-yl)phenyl]-6-chloro-1H-indole-3-carbaldehyde

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