Carbonic acid, 4-[1-(4-hydroxyphenyl)-1-methylethyl]phenyl methyl ester

Base Information

• Chemical Name: Carbonic acid, 4-[1-(4-hydroxyphenyl)-1-methylethyl]phenyl methyl ester
• CAS No.: 122890-41-9
• Molecular Formula: C17H18O4
• Molecular Weight: 286.328
• DSSTox Substance ID: DTXSID00454004
• Nikkaji Number: J2.801.965C
• Wikidata: Q82275319
• Mol file: 122890-41-9.mol

Synonyms:Carbonic acid, 4-[1-(4-hydroxyphenyl)-1-methylethyl]phenyl methyl ester;122890-41-9;SCHEMBL13799434;DTXSID00454004;4-[1-[4-(Methoxycarbonyloxy)phenyl]-1-methylethyl]phenol

Chemical Property of Carbonic acid, 4-[1-(4-hydroxyphenyl)-1-methylethyl]phenyl methyl ester

Chemical Property:

• XLogP3: 4.5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 5
• Exact Mass: 286.12050905
• Heavy Atom Count: 21
• Complexity: 337

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

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

Technology Process of Carbonic acid, 4-[1-(4-hydroxyphenyl)-1-methylethyl]phenyl methyl ester

There total 7 articles about Carbonic acid, 4-[1-(4-hydroxyphenyl)-1-methylethyl]phenyl methyl ester 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: 91.0%

Benzohydroxamic acid (495-18-1) → BPA (80-05-7) + C17H18O4 (122890-41-9,24936-68-3) + 3-phenyl-5H-1,4,2-dioxazol-5-one (19226-36-9)

Guidance literature:

With 1,8-diazabicyclo[5.4.0]undec-7-ene; In 2-methyltetrahydrofuran; at 30 ℃; for 4h; Reagent/catalyst; Catalytic behavior;

DOI:10.1002/cssc.202100885

Reference yield:

BPA (80-05-7) + carbonic acid dimethyl ester (616-38-6) → methanol (67-56-1) + C17H18O4 (122890-41-9,24936-68-3) + bisphenol A bis(methyl carbonate) (4824-74-2,24936-68-3)

Guidance literature:

With diphenyltin(IV) oxide; at 120 ℃; for 16h; Inert atmosphere;

DOI:10.1016/j.catcom.2012.12.017

Reference yield:

BPA (80-05-7) + carbonic acid dimethyl ester (616-38-6) → methanol (67-56-1) + C17H18O4 (122890-41-9,24936-68-3) + p-<1-(4-methoxyphenyl)-1-methylethyl>phenol (16530-58-8)

Guidance literature:

With diphenyltin(IV) oxide; at 180 ℃; for 16h; Inert atmosphere;

DOI:10.1016/j.catcom.2012.12.017

upstream raw materials:

BPA

carbonic acid dimethyl ester

Benzohydroxamic acid

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