Methyl 3-(benzyloxy)cyclobutanecarboxylate

Base Information

• Chemical Name: Methyl 3-(benzyloxy)cyclobutanecarboxylate
• CAS No.: 84182-50-3
• Molecular Formula: C13H16O3
• Molecular Weight: 220.268
• DSSTox Substance ID: DTXSID30965355,DTXSID101218003
• Mol file: 84182-50-3.mol

Synonyms:METHYL 3-(BENZYLOXY)CYCLOBUTANECARBOXYLATE;4934-98-9;84182-49-0;Methyl cis-3-(benzyloxy)cyclobutanecarboxylate;Methyl trans-3-(benzyloxy)cyclobutanecarboxylate;84182-50-3;METHYL 3-(BENZYLOXY)CYCLOBUTANE-1-CARBOXYLATE;methyl 3-phenylmethoxycyclobutane-1-carboxylate;MFCD00513559;5107-93-7;Cyclobutanecarboxylic acid, 3-(phenylmethoxy)-, methyl ester;CBMicro_004971;SCHEMBL760582;SCHEMBL760583;Cyclobutanecarboxylicacid,3-(phenylmethoxy)-,methylester;SCHEMBL10232132;trans-3-benzyloxy-cyclobutanecarboxylic acid methyl ester;DTXSID30965355;COSCRJLYEZUUMW-HAQNSBGRSA-N;COSCRJLYEZUUMW-UHFFFAOYSA-N;CIS-3-BENZYLOXYCYCLOBUTANECARBOXYLIC ACID METHYL ESTER;DTXSID101218003;SMSF0003306;TRANS-3-BENZYLOXYCYCLOBUTANECARBOXYLIC ACID METHYL ESTER;AKOS015904253;CB06969;PB16966;PB18500;PB35044;BS-28744;SY263529;BIM-0004855.P001;CS-0006609;CS-0055362;CS-0055363;Methylcis-3-(benzyloxy)cyclobutanecarboxylate;P10131;P13074;P13075;A827702;J-520134;Methyl trans-3-(phenylmethoxy)cyclobutanecarboxylate;5-METHYL-[1,3,4]OXADIAZOLE-2-CARBOXYLICACID;cis-3-(phenylmethoxy)cyclobutanecarboxylic acid methyl ester;Cyclobutanecarboxylic acid,3-(phenylmethoxy)-,methyl ester,cis-;Cyclobutanecarboxylic acid, 3-(phenylmethoxy)-, methyl ester, cis-

Chemical Property of Methyl 3-(benzyloxy)cyclobutanecarboxylate

Chemical Property:

• XLogP3: 2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 5
• Exact Mass: 220.109944368
• Heavy Atom Count: 16
• Complexity: 227

Purity/Quality:

97% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: COC(=O)C1CC(C1)OCC2=CC=CC=C2

Technology Process of Methyl 3-(benzyloxy)cyclobutanecarboxylate

There total 2 articles about Methyl 3-(benzyloxy)cyclobutanecarboxylate 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: 15.4%

methylester of 3-hydroxycyclobutane-1-carboxylic acid (4934-99-0) + benzyl bromide (100-39-0) → methyl (E)-3-benzyloxycyclobutane-1-carboxylate (84182-50-3)

Guidance literature:

methylester of 3-hydroxycyclobutane-1-carboxylic acid; With sodium hydride; In N,N-dimethyl-formamide; at 0 ℃; for 0.25h;

benzyl bromide; In N,N-dimethyl-formamide; at 0 - 2 ℃; for 2h;

Reference yield:

methylester of 3-hydroxycyclobutane-1-carboxylic acid (4934-99-0) + benzyl bromide (100-39-0) → methyl (E)-3-benzyloxycyclobutane-1-carboxylate (84182-50-3) + methyl (Z)-3-benzyloxycyclobutane-1-carboxylate

Guidance literature:

methylester of 3-hydroxycyclobutane-1-carboxylic acid; With sodium hydride; In tetrahydrofuran; mineral oil; at 0 ℃; for 0.166667h;

benzyl bromide; In tetrahydrofuran; mineral oil; at 20 ℃; for 2h;

Reference yield: 94.5%

methyl (E)-3-benzyloxycyclobutane-1-carboxylate (84182-50-3) → methyl (1r,3r)-3-hydroxycyclobutane-1-carboxylate (63485-51-8)

Guidance literature:

With hydrogen; palladium on activated charcoal; In methanol; at 40 ℃; under 7500.75 Torr;

upstream raw materials:

methylester of 3-hydroxycyclobutane-1-carboxylic acid

benzyl bromide

Downstream raw materials:

methyl (1r,3r)-3-hydroxycyclobutane-1-carboxylate