Carbamic acid, (5-oxononyl)-, phenylmethyl ester

Base Information

Chemical Name:Carbamic acid, (5-oxononyl)-, phenylmethyl ester
CAS No.:116437-36-6
Molecular Formula:C17H25NO3
Molecular Weight:291.39
Hs Code.:
DSSTox Substance ID:DTXSID30445849
Wikidata:Q82264384
Mol file:116437-36-6.mol

Synonyms:Carbamic acid, (5-oxononyl)-, phenylmethyl ester;116437-36-6;DTXSID30445849

Suppliers and Price of Carbamic acid, (5-oxononyl)-, phenylmethyl 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
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price

Total 1 raw suppliers

Chemical Property of Carbamic acid, (5-oxononyl)-, phenylmethyl ester

Chemical Property:

XLogP3:3.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:11
Exact Mass:291.18344366
Heavy Atom Count:21
Complexity:298

Purity/Quality:: 99.90% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCCCC(=O)CCCCNC(=O)OCC1=CC=CC=C1

Technology Process of Carbamic acid, (5-oxononyl)-, phenylmethyl ester

There total 5 articles about Carbamic acid, (5-oxononyl)-, phenylmethyl 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: 35.0%

: 109-72-8,29786-93-4
n-butyllithium

: 106412-35-5
N-benzyloxycarbonyl-2-piperidone

: 10361-39-4
benzyl pentanoate

: 116437-36-6
benzyl [N-(5-oxononyl)amino]methanoate

: 100-51-6,185532-71-2
benzyl alcohol

Guidance literature:: In tetrahydrofuran; at -78 ℃; for 3h;
DOI:10.1021/jo00262a048

Reference yield:

: 23135-50-4
5-(N-benzyloxycarbonylamino)pentanoic acid

: 116437-36-6
benzyl [N-(5-oxononyl)amino]methanoate

Guidance literature:: Multi-step reaction with 3 steps

1: 4-methylmorpholine / CH₂Cl₂ / 0.75 h / -15 °C

2: CH₂Cl₂ / 3 h / -15 °C

3: tetrahydrofuran; diethyl ether / 1 h / -78 - 0 °C

With 4-methyl-morpholine; In tetrahydrofuran; diethyl ether; dichloromethane;
DOI:10.1021/jm970020k

Reference yield:

: 501-53-1,94274-21-2
benzyl chloroformate

: 116437-36-6
benzyl [N-(5-oxononyl)amino]methanoate

Guidance literature:: Multi-step reaction with 4 steps

1: K₂CO₃

2: 4-methylmorpholine / CH₂Cl₂ / 0.75 h / -15 °C

3: CH₂Cl₂ / 3 h / -15 °C

4: tetrahydrofuran; diethyl ether / 1 h / -78 - 0 °C

With 4-methyl-morpholine; potassium carbonate; In tetrahydrofuran; diethyl ether; dichloromethane;
DOI:10.1021/jm970020k