Benzyl morpholine-4-carboxylate

Base Information

• Chemical Name: Benzyl morpholine-4-carboxylate
• CAS No.: 25070-73-9
• Molecular Formula: C12H15NO3
• Molecular Weight: 221.256
• Hs Code.: 2934999090
• DSSTox Substance ID: DTXSID30495662
• Nikkaji Number: J2.004.995B
• Wikidata: Q82343910
• Mol file: 25070-73-9.mol

Synonyms:Benzyl morpholine-4-carboxylate;25070-73-9;4-Morpholinecarboxylic acid, phenylmethyl ester;1-N-CBZ-MORPHOLINE;N-carbobenzyloxymorpholine;Benzylmorpholine-4-carboxylate;SCHEMBL14095609;DTXSID30495662;MFCD11111783;AKOS024285894;DS-19663;CS-0160284;C74290;EN300-263836;Z31721807

Chemical Property of Benzyl morpholine-4-carboxylate

Chemical Property:

• Melting Point: 47-49 °C
• Boiling Point: 349.7±42.0 °C(Predicted)
• PKA: -1.63±0.20(Predicted)
• PSA: 38.77000
• Density: 1.183±0.06 g/cm3(Predicted)
• LogP: 1.59330
• Storage Temp.: Sealed in dry,Room Temperature
• XLogP3: 1.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 221.10519334
• Heavy Atom Count: 16
• Complexity: 220

Purity/Quality:

99% ^*data from raw suppliers

Benzylmorpholine-4-carboxylate 97% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1COCCN1C(=O)OCC2=CC=CC=C2

Technology Process of Benzyl morpholine-4-carboxylate

There total 10 articles about Benzyl morpholine-4-carboxylate 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: 96.0%

morpholine (110-91-8,99108-56-2) + benzyl chloroformate (501-53-1,94274-21-2) → benzyl morpholine-4-carboxylate (25070-73-9)

Guidance literature:

With aluminum oxide; at 25 ℃; for 0.0833333h;

DOI:10.1021/jo035412f

Reference yield: 92.0%

morpholine (110-91-8,99108-56-2) + N-(Benzyloxycarbonyloxy)succinimide (13139-17-8) → benzyl morpholine-4-carboxylate (25070-73-9)

Guidance literature:

With 1-butyl-3-methylimidazolium Tetrafluoroborate; In neat (no solvent); at 25 ℃; for 0.0666667h;

DOI:10.1039/c5ra12121c

Reference yield: 88.0%

morpholine (110-91-8,99108-56-2) + 5-propyl-benzo[1,3]dioxol-2-one + benzyl alcohol (100-51-6,185532-71-2) → benzyl morpholine-4-carboxylate (25070-73-9)

Guidance literature:

5-propyl-benzo[1,3]dioxol-2-one; benzyl alcohol; With zinc(II) acetate dihydrate; at 50 ℃; for 16h; Sealed tube;

morpholine; In 2-methyltetrahydrofuran; at 25 ℃; for 16h; Sealed tube;

DOI:10.1002/cssc.201900406

upstream raw materials:

morpholine

benzyl (1-chloroethyl) carbonate

benzyl chloroformate

benzyl alcohol

Downstream raw materials:

morpholine

methanol