4-Benzyloxypropiophenone

Base Information

• Chemical Name: 4-Benzyloxypropiophenone
• CAS No.: 4495-66-3
• Molecular Formula: C16H16O2
• Molecular Weight: 240.302
• Hs Code.: 2914509090
• European Community (EC) Number: 224-788-2
• NSC Number: 41188
• UNII: 3AE8SS5B76
• DSSTox Substance ID: DTXSID70196343
• Nikkaji Number: J32.010B
• Wikidata: Q72442540
• Mol file: 4495-66-3.mol

Synonyms:4-Benzyloxypropiophenone;4495-66-3;1-(4-(benzyloxy)phenyl)propan-1-one;p-Benzyloxypropiophenone;4'-Benzyloxypropiophenone;4-Benzyloxy-propiophenone;1-Propanone, 1-[4-(phenylmethoxy)phenyl]-;1-[4-(Benzyloxy)phenyl]propan-1-one;1-(4-phenylmethoxyphenyl)propan-1-one;4'-(benzyloxy)propiophenone;1-(4-benzyloxyphenyl)propan-1-one;EINECS 224-788-2;NSC-41188;1-[4-(Phenylmethoxy)phenyl]-1-propanone;1-[4-(Benzyloxy)phenyl]-1-propanone;1-Propanone, 1-(4-(phenylmethoxy)phenyl)-;NSC41188;4-benzyloxy propiophenone;p-(benzyloxy)propiophenone;4''-Benzyloxypropiophenone;4'-(benzyloxy)-Propiophenone;SCHEMBL102983;3AE8SS5B76;Propiophenone, 4'-(benzyloxy)-;DTXSID70196343;STR06699;1-(4-benzyloxyphenyl)propane-1-one;MFCD00009311;NSC 41188;1-(4-Benzyloxy)phenyl)propan-1-one;AKOS000202212;AM81004;CS-W012805;1-[4-(Benzyloxy)phenyl]-1-propanone #;AC-12380;2-(2-Methoxybenzoyl)hydrazinecarbothioamide;FT-0616698;I11696;A826694;W-106173

Chemical Property of 4-Benzyloxypropiophenone

Chemical Property:

• Appearance/Colour: off-white to light beige powder
• Melting Point: 99-102 °C
• Refractive Index: 1.6000 (estimate)
• Boiling Point: 391.023 °C at 760 mmHg
• Flash Point: 174.419 °C
• PSA: 26.30000
• Density: 1.082 g/cm³
• LogP: 3.85830
• XLogP3: 3.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 5
• Exact Mass: 240.115029749
• Heavy Atom Count: 18
• Complexity: 248

Purity/Quality:

98%,99%, ^*data from raw suppliers

4'-(Benzyloxy)propiophenone 98% ^*data from reagent suppliers

Safty Information:

• Safety Statements: 24/25

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC(=O)C1=CC=C(C=C1)OCC2=CC=CC=C2
• Uses: 4'-(Benzyloxy)propiophenone is a reactant used in the preparation of phenyl ether derivatives with pesticidal and antitumor activity.

Technology Process of 4-Benzyloxypropiophenone

There total 14 articles about 4-Benzyloxypropiophenone 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: 100.0%

benzyl bromide (100-39-0) + 4-hydroxypropiophenone (70-70-2) → 4-benzyloxypropiophenone (4495-66-3)

Guidance literature:

With potassium carbonate; In acetone; Heating / reflux;

Reference yield: 91.5%

benzyl chloride (100-44-7) + 4-hydroxypropiophenone (70-70-2) → 4-benzyloxypropiophenone (4495-66-3)

Guidance literature:

With potassium carbonate; In acetone; for 24h; Reflux;

Reference yield: 87.0%

(E)-(benzyloxy)-4-(3-chloroprop-1-enyl)benzene (87030-16-8) → 4-benzyloxypropiophenone (4495-66-3)

Guidance literature:

With potassium carbonate; phenylboronic acid; [Ru(cyclopentadienyl)(MeCN)3]PF₆; In acetonitrile; at 20 ℃; for 3h;

DOI:10.1039/b801159a

upstream raw materials:

sodium ethanolate

benzyl bromide

4-hydroxypropiophenone

benzyl chloride

Downstream raw materials:

4-(4-benzyloxy-phenyl)-5-methyl-oxazole

1-(4-Benzyloxy-phenyl)-2-methyl-3-phenyl-butan-1-one

(Z)-1-(4-benzyloxyphenyl)-1-triethylsiloxy-1-propene

Acetic acid 2-(4-benzyloxy-phenyl)-1-methyl-2-oxo-ethyl ester

Refernces

• 1、 Huang, Binbin,Guo, Lin,Xia, Wujiong. "A facile and versatile electro-reductive system for hydrodefunctionalization under ambient conditions". supporting information. p. 2095 - 2103. Retrieved 2021/03/26.
• 2、 Argaez, Aida Nelly Garcia,Dalla Via, Lisa,Hyeraci, Mariafrancesca,Kikelj, Danijel,Ma?i?, Lucija Peterlin,Passarella, Daniele,Secci, Daniela,Toma?i?, Tihomir,Zidar, Nace. "Synthesis, Antiproliferative Effect, and Topoisomerase II Inhibitory Activity of 3-Methyl-2-phenyl-1 H-indoles". . p. 691 - 697. Retrieved 2020/07/14.