[(4-Methoxyphenyl)-phenylmethyl] phenyl carbonate

Base Information

• Chemical Name: [(4-Methoxyphenyl)-phenylmethyl] phenyl carbonate
• CAS No.: 31558-55-1
• Molecular Formula: C21H18 O4
• Molecular Weight: 334.372
• NSC Number: 171057
• DSSTox Substance ID: DTXSID60305543
• Nikkaji Number: J2.534.134A
• Mol file: 31558-55-1.mol

Synonyms:31558-55-1;[(4-methoxyphenyl)-phenylmethyl] phenyl carbonate;NSC171057;DTXSID60305543;NSC-171057

Chemical Property of [(4-Methoxyphenyl)-phenylmethyl] phenyl carbonate

Chemical Property:

• Vapor Pressure: 1.39E-09mmHg at 25°C
• Boiling Point: 485.6°Cat760mmHg
• Flash Point: 213.4°C
• Density: 1.185g/cm³
• XLogP3: 5.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 7
• Exact Mass: 334.12050905
• Heavy Atom Count: 25
• Complexity: 391

Purity/Quality:

99%min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=CC=C(C=C1)C(C2=CC=CC=C2)OC(=O)OC3=CC=CC=C3

Technology Process of [(4-Methoxyphenyl)-phenylmethyl] phenyl carbonate

There total 3 articles about [(4-Methoxyphenyl)-phenylmethyl] phenyl carbonate 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: 77.0%

1-(4-methoxyphenyl)-1-phenylmethanol (720-44-5) + phenyl chloroformate (1885-14-9) → 4-methoxybenzhydryl phenyl carbonate (31558-55-1)

Guidance literature:

With pyridine; In benzene; at 20 ℃; for 12h;

DOI:10.1021/jo701379n

Reference yield:

4-methoxy-benzaldehyde (123-11-5) → 4-methoxybenzhydryl phenyl carbonate (31558-55-1)

Guidance literature:

Multi-step reaction with 2 steps

2: Py

With pyridine;

DOI:10.1139/v71-150

Reference yield:

phenylmagnesium bromide → 4-methoxybenzhydryl phenyl carbonate (31558-55-1)

Guidance literature:

Multi-step reaction with 2 steps

2: Py

With pyridine;

DOI:10.1139/v71-150

upstream raw materials:

1-(4-methoxyphenyl)-1-phenylmethanol

phenyl chloroformate

4-methoxy-benzaldehyde

Downstream raw materials:

phenyl carbonic acid

1-(4-methoxyphenyl)-1-phenylmethanol

(RS)-1-(ethoxyphenylmethyl)-4-methoxybenzene

Refernces

• 1、 Denegri, Bernard,Kronja, Olga. "Nucleofugality of phenyl and methyl carbonates". . p. 8427 - 8433. Retrieved 2008/03/12.