2-{[(Diethylamino)carbonyl]amino}-N,N-diethylbenzamide

Base Information

Chemical Name:2-{[(Diethylamino)carbonyl]amino}-N,N-diethylbenzamide
CAS No.:78554-91-3
Molecular Formula:C16H25N3O2
Molecular Weight:291.393
Hs Code.:2924299090
DSSTox Substance ID:DTXSID90406517
Nikkaji Number:J1.177.662K
Wikidata:Q82211511
Mol file:78554-91-3.mol

Synonyms:78554-91-3;2-{[(DIETHYLAMINO)CARBONYL]AMINO}-N,N-DIETHYLBENZAMIDE;2-(3,3-Diethylureido)-N,N-diethylbenzamide;2-(diethylcarbamoylamino)-N,N-diethylbenzamide;2-[(diethylcarbamoyl)amino]-N,N-diethylbenzamide;ST080628;DTXSID90406517;AKOS000499545;CS-0331056

Suppliers and Price of 2-{[(Diethylamino)carbonyl]amino}-N,N-diethylbenzamide

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

Matrix Scientific
2-{[(Diethylamino)carbonyl]amino}-N,N-diethylbenzamide
500mg
$ 199.00

Crysdot
2-(3,3-Diethylureido)-N,N-diethylbenzamide 95+%
5g
$ 627.00

Aronis compounds
2-{[(diethylamino)carbonyl]amino}-N,N-diethylbenzamide
10g
$ 503.00

AK Scientific
2-{[(Diethylamino)carbonyl]amino}-N,N-diethylbenzamide
500mg
$ 318.00

Total 5 raw suppliers

Chemical Property of 2-{[(Diethylamino)carbonyl]amino}-N,N-diethylbenzamide

Chemical Property:

Boiling Point:491.5±37.0 °C(Predicted)
PKA:14?+-.0.70(Predicted)
PSA：52.65000
Density:1.088±0.06 g/cm3(Predicted)
LogP:3.11530
XLogP3:3.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:6
Exact Mass:291.19467705
Heavy Atom Count:21
Complexity:338

Purity/Quality:

98%min ^*data from raw suppliers

2-{[(Diethylamino)carbonyl]amino}-N,N-diethylbenzamide ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCN(CC)C(=O)C1=CC=CC=C1NC(=O)N(CC)CC

Technology Process of 2-{[(Diethylamino)carbonyl]amino}-N,N-diethylbenzamide

There total 1 articles about 2-{[(Diethylamino)carbonyl]amino}-N,N-diethylbenzamide 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: 88.0%

: 57212-70-1
N-(mesyloxy)phthalimide

: 109-89-7
diethylamine

: 78554-91-3
2-(3,3-diethylureido)-N,N-diethylbenzamide

Guidance literature:: In toluene; at 20 ℃; for 7h;
DOI:10.1021/jo9900634

Reference yield:

: 78554-91-3
2-(3,3-diethylureido)-N,N-diethylbenzamide

: 118-48-9
isatoic anhydride

Guidance literature:: Multi-step reaction with 4 steps

1: conc. H₂SO₄ / 3 h / 80 °C

2: 85 percent / acetone / 72 h / 20 °C

3: 63 percent / aq. HCl / 336 h / 5 °C

4: aq. HCl / 0.17 h / Heating

With hydrogenchloride; sulfuric acid; In acetone; 1: Cyclization / 2: Ring cleavage / 3: Elimination / 4: Cyclization;
DOI:10.1021/jo9900634