N-Benzoylmeroquinene tert-Butyl Ester

Base Information

Chemical Name:N-Benzoylmeroquinene tert-Butyl Ester
CAS No.:52346-13-1
Molecular Formula:C20H27NO3
Molecular Weight:329.43
Hs Code.:2933399090
DSSTox Substance ID:DTXSID60473291
Wikidata:Q76422110
Mol file:52346-13-1.mol

Synonyms:N-Benzoylmeroquinene tert-Butyl Ester;52346-13-1;tert-Butyl 2-((3R,4S)-1-benzoyl-3-vinylpiperidin-4-yl)acetate;tert-butyl 2-[(3R,4S)-1-benzoyl-3-ethenylpiperidin-4-yl]acetate;DTXSID60473291;(3R,4S)-1-Benzoyl-3-vinyl-4-piperidineacetic Acid tert-Butyl Ester;MFCD08276275;B2361;CS-0201672;T70999;tert-Butyl (3R,4S)-1-Benzoyl-3-vinyl-4-piperidineacetate;tert-Butyl2-((3R,4S)-1-benzoyl-3-vinylpiperidin-4-yl)acetate

Suppliers and Price of N-Benzoylmeroquinene tert-Butyl Ester

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

TRC
N-Benzoylmeroquinene tert-Butyl Ester
50mg
$ 90.00

TCI Chemical
N-Benzoylmeroquinene tert-Butyl Ester >98.0%(N)
1g
$ 421.00

Crysdot
tert-Butyl2-((3R,4S)-1-benzoyl-3-vinylpiperidin-4-yl)acetate 95+%
1g
$ 323.00

Chem-Impex
N-Benzoylmeroquinenetert-butylester,98% 98%
1G
$ 462.56

American Custom Chemicals Corporation
N-BENZOYLMEROQUINENE-TERT-BUTYL ESTER 95.00%
5MG
$ 500.09

AK Scientific
N-Benzoylmeroquinene tert-Butyl Ester
1g
$ 612.00

Total 6 raw suppliers

Chemical Property of N-Benzoylmeroquinene tert-Butyl Ester

Chemical Property:

Vapor Pressure:8.45E-08mmHg at 25°C
Melting Point:64 °C
Refractive Index:1.551
Boiling Point:435.9°C at 760 mmHg
Flash Point:217.4°C
PSA：46.61000
Density:1.088g/cm³
LogP:3.62060
Solubility.:soluble in Methanol
XLogP3:3.5
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:6
Exact Mass:329.19909372
Heavy Atom Count:24
Complexity:460

Purity/Quality:

98%,99%, ^*data from raw suppliers

N-Benzoylmeroquinene tert-Butyl Ester ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(C)(C)OC(=O)CC1CCN(CC1C=C)C(=O)C2=CC=CC=C2
Isomeric SMILES:CC(C)(C)OC(=O)C[C@@H]1CCN(C[C@@H]1C=C)C(=O)C2=CC=CC=C2

Technology Process of N-Benzoylmeroquinene tert-Butyl Ester

There total 4 articles about N-Benzoylmeroquinene tert-Butyl 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: 95.0%

: 52346-11-9
tert-butyl 2-[(3R,4S)-3-ethenylpiperidin-4-yl]acetate

: 98-88-4
benzoyl chloride

: 52346-13-1
N-benzoylmeroquinene tert-butyl ester

Guidance literature:: With pyridine; In dichloromethane; at 20 ℃; for 2.25h; Reflux; Inert atmosphere;
DOI:10.15227/orgsyn.075.0223

Reference yield:

: 84-31-1
quininone

: 52346-13-1
N-benzoylmeroquinene tert-butyl ester

Guidance literature:: Multi-step reaction with 2 steps

1.1: oxygen / tert-butyl alcohol; tetrahydrofuran / 0.25 h / Cooling with ice

1.2: 1.67 h / 20 - 35 °C

2.1: pyridine / dichloromethane / 2.25 h / 20 °C / Reflux; Inert atmosphere

With pyridine; oxygen; In tetrahydrofuran; dichloromethane; tert-butyl alcohol;
DOI:10.15227/orgsyn.075.0223

Reference yield:

: 130-95-0
quinine

: 52346-13-1
N-benzoylmeroquinene tert-butyl ester

Guidance literature:: Multi-step reaction with 3 steps

1.1: benzophenone; potassium tert-butylate / toluene / 8 h / Inert atmosphere; Reflux

2.1: oxygen / tert-butyl alcohol; tetrahydrofuran / 0.25 h / Cooling with ice

2.2: 1.67 h / 20 - 35 °C

3.1: pyridine / dichloromethane / 2.25 h / 20 °C / Reflux; Inert atmosphere

With pyridine; benzophenone; potassium tert-butylate; oxygen; In tetrahydrofuran; dichloromethane; toluene; tert-butyl alcohol;
DOI:10.15227/orgsyn.075.0223