[2-(4-Benzylpiperidin-1-yl)-2-oxoethyl] 2-methylbenzoate

Base Information

Chemical Name:[2-(4-Benzylpiperidin-1-yl)-2-oxoethyl] 2-methylbenzoate
CAS No.:6554-21-8
Molecular Formula:C₁₂H₁₅N₅O₅
Molecular Weight:309.282
Hs Code.:
DSSTox Substance ID:DTXSID70368144
Wikidata:Q82154492
Mol file:6554-21-8.mol

Synonyms:[2-(4-benzylpiperidin-1-yl)-2-oxoethyl] 2-methylbenzoate;Oprea1_781607;DTXSID70368144;AKOS033614509;AB00710549-01;Z18382441

Suppliers and Price of [2-(4-Benzylpiperidin-1-yl)-2-oxoethyl] 2-methylbenzoate

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

Total 6 raw suppliers

Chemical Property of [2-(4-Benzylpiperidin-1-yl)-2-oxoethyl] 2-methylbenzoate

Chemical Property:

Vapor Pressure:1.8E-11mmHg at 25°C
Boiling Point:533.8°Cat760mmHg
Flash Point:276.6°C
PSA：46.61000
Density:1.149g/cm³
LogP:3.57100
XLogP3:4.4
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:6
Exact Mass:351.18344366
Heavy Atom Count:26
Complexity:464

Purity/Quality:: 97% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1=CC=CC=C1C(=O)OCC(=O)N2CCC(CC2)CC3=CC=CC=C3

Technology Process of [2-(4-Benzylpiperidin-1-yl)-2-oxoethyl] 2-methylbenzoate

There total 6 articles about [2-(4-Benzylpiperidin-1-yl)-2-oxoethyl] 2-methylbenzoate 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%

: 21160-02-1
benzophenone O-acetyl oxime

: 58-61-7
adenosine

: 6554-21-8
3'-O-Acetyl-adenosin

Guidance literature:: With Pseudomonas Cepacia lipase on ceramic; In tetrahydrofuran; at 20 ℃; for 25h;
DOI:10.1080/00397910008086919

Reference yield:

: 108-05-4,9003-20-7
vinyl acetate

: 58-61-7
adenosine

: 6554-28-5
2'-O-acetyladenosine

: 6554-21-8
3'-O-Acetyl-adenosin

Guidance literature:: With PSL; In tetrahydrofuran; at 60 ℃; for 48h; Title compound not separated from byproducts;
DOI:10.1016/S0040-4020(00)00222-2

Reference yield:

: 108-24-7
acetic anhydride

: 58-61-7
adenosine

: 6554-28-5
2'-O-acetyladenosine

: 6554-21-8
3'-O-Acetyl-adenosin

Guidance literature:: With Candida Cyclindracea lipase; In tert-butyl alcohol; at 37 ℃; for 8h; Reagent/catalyst; Overall yield = 83 %; regioselective reaction; Enzymatic reaction;