2-Methyl-2-phenyloxetane

Base Information

• Chemical Name: 2-Methyl-2-phenyloxetane
• CAS No.: 19352-10-4
• Molecular Formula: C10H12O
• Molecular Weight: 148.205
• DSSTox Substance ID: DTXSID70448697
• Nikkaji Number: J1.230.190A
• Mol file: 19352-10-4.mol

Synonyms:2-Methyl-2-phenyloxetane;19352-10-4;2-phenyl-2-methyloxetane;DTXSID70448697;AKOS022172915;FT-0718904

Chemical Property of 2-Methyl-2-phenyloxetane

Chemical Property:

• PSA: 9.23000
• LogP: 2.32210
• Storage Temp.: 2-8°C
• XLogP3: 1.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 148.088815002
• Heavy Atom Count: 11
• Complexity: 138

Purity/Quality:

99% ^*data from raw suppliers

2-Methyl-2-phenyloxetane 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1(CCO1)C2=CC=CC=C2

Technology Process of 2-Methyl-2-phenyloxetane

There total 6 articles about 2-Methyl-2-phenyloxetane 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: 90.0%

2-phenyloxetane (4436-23-1) + methyl iodide (74-88-4) → 2-methyl-2-phenyloxetane (19352-10-4)

Guidance literature:

2-phenyloxetane; With sec.-butyllithium; In tetrahydrofuran; cyclohexane; at -78 ℃; for 0.0833333h; Inert atmosphere;

methyl iodide; In tetrahydrofuran; cyclohexane; at -78 ℃; regioselective reaction; Inert atmosphere;

DOI:10.1039/c1cc13670d

Reference yield: 90.0%

dimethylsulfoxonium methylide (70775-39-2,5367-24-8) + acetophenone (98-86-2) → 2-methyl-2-phenyloxetane (19352-10-4)

Guidance literature:

at 50 ℃; for 72h; Inert atmosphere;

DOI:10.1002/anie.201109113

Reference yield: 89.0%

trimethylsulfoxonium iodide (1774-47-6) + acetophenone (98-86-2) → 2-methyl-2-phenyloxetane (19352-10-4)

Guidance literature:

trimethylsulfoxonium iodide; With potassium tert-butylate; In tert-butyl alcohol; at 50 ℃; for 0.5h; Green chemistry;

acetophenone; In tert-butyl alcohol; for 72h; Heating; Green chemistry;

DOI:10.1002/anie.201915772

upstream raw materials:

S-methyl-S-morpholino-N-<(4-methylphenyl)sulfonyl>sulfoximine

dimethyl sulfoxide

acetophenone

2-phenyloxetane

Downstream raw materials:

3-phenyl-1-butanol

3-phenylbut-3-en-1-ol

3-Phenyl-3-methoxy-butanol-1

3-Amino-3-phenyl-butan-1-ol