4-(Benzyloxy)-3-chlorophenol

Base Information

• Chemical Name: 4-(Benzyloxy)-3-chlorophenol
• CAS No.: 86902-27-4
• Molecular Formula: C13H11ClO2
• Molecular Weight: 234.682
• Hs Code.: 2909500000
• DSSTox Substance ID: DTXSID90528122
• Wikidata: Q82397505
• Mol file: 86902-27-4.mol

Synonyms:4-(Benzyloxy)-3-chlorophenol;86902-27-4;4-Benzyloxy-3-chlorophenol;4-Benzyloxy-3-chloro-phenol;3-chloro-4-phenylmethoxyphenol;SCHEMBL1532826;DTXSID90528122;PQBMHARERZHVJP-UHFFFAOYSA-N;MFCD11848188;AKOS016007307;CS-0195032;N12855;A848100

Chemical Property of 4-(Benzyloxy)-3-chlorophenol

Chemical Property:

• PSA: 29.46000
• LogP: 3.62460
• Storage Temp.: Sealed in dry,Room Temperature
• XLogP3: 3.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 234.0447573
• Heavy Atom Count: 16
• Complexity: 204

Purity/Quality:

99%min ^*data from raw suppliers

4-(Benzyloxy)-3-chlorophenol ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)COC2=C(C=C(C=C2)O)Cl

Technology Process of 4-(Benzyloxy)-3-chlorophenol

There total 6 articles about 4-(Benzyloxy)-3-chlorophenol 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: 87.0%

4-benzyloxy-3-chlorobenzaldehyde (66422-84-2) → 3-chloro-4-benzyloxyphenol (86902-27-4)

Guidance literature:

4-benzyloxy-3-chlorobenzaldehyde; With 3-chloro-benzenecarboperoxoic acid; In dichloromethane; at 20 ℃; for 120h;

With sodium hydroxide; In methanol; for 1h; Further stages.;

DOI:10.1021/jm070034i

Reference yield: 35.0%

→ 3-chloro-4-benzyloxyphenol (86902-27-4)

Guidance literature:

Reference yield:

sodium metabisulfite + 4-benzyloxy-3-chlorobenzaldehyde (66422-84-2) → 3-chloro-4-benzyloxyphenol (86902-27-4)

Guidance literature:

With sodium ethanolate; sodium hydrogencarbonate; In ethanol; dichloromethane; water;

upstream raw materials:

4-benzyloxy-3-chlorobenzaldehyde

4-hydroxy-3-chlorobenzaldehyde

benzyl bromide

Downstream raw materials:

1-(benzyloxy)-2-chloro-4-<2-<(2-phenylethyl)oxy>ethoxy>benzene

4-(4-(benzyloxy)-3-chlorophenoxy)-pyridine-2-carboxylic acid methylamide

4-(4-(benzyloxy)-3-chlorophenoxy)quinoline

1-[2-chloro-4-[2-(phenethyloxy)ethoxy]phenoxy]-3-isopropylamino-2-propanol

Refernces

• 1、 Potashman, Michele H.,Bready, James,Coxon, Angela,Demelfi Jr., Thomas M.,DiPietro, Lucian,Doerr, Nicholas,Elbaum, Daniel,Estrada, Juan,Gallant, Paul,Germain, Julie,Gu, Yan,Harmange, Jean-Christophe,Kaufman, Stephen A.,Kendall, Rick,Kim, Joseph L.,Kumar, Gondi N.,Long, Alexander M.,Neervannan, Seshadri,Patel, Vinod F.,Polverino, Anthony,Rose, Paul,Van Der Plas, Simon,Whittington, Douglas,Zanon, Roger,Zhao, Huilin. "Design, synthesis, and evaluation of orally active benzimidazoles and benzoxazoles as vascular endothelial growth factor-2 receptor tyrosine kinase inhibitors". . p. 4351 - 4373. Retrieved 2008/02/13.
• 2、 -. "SUBSTITUTED PHENOXY-AMINOPROPANOLS". . . Retrieved 2008/06/13.