7-Diethylamino-3-((((2-iodoacetamido)ethyl) amino)carbonyl)coumarin

Base Information

Chemical Name:7-Diethylamino-3-((((2-iodoacetamido)ethyl) amino)carbonyl)coumarin
CAS No.:160291-50-9
Molecular Formula:C₁₈H₂₂IN₃O₄
Molecular Weight:471.295
Hs Code.:
DSSTox Substance ID:DTXSID90376347
Nikkaji Number:J613.163H
Wikidata:Q82165277
Mol file:160291-50-9.mol

Synonyms:160291-50-9;7-Diethylamino-3-((((2-iodoacetamido)ethyl) amino)carbonyl)coumarin;7-(diethylamino)-N-[2-[(2-iodoacetyl)amino]ethyl]-2-oxochromene-3-carboxamide;7-(Diethylamino)-N-(2-(2-iodoacetamido)ethyl)-2-oxo-2H-chromene-3-carboxamide;IDCC;SCHEMBL2184853;DTXSID90376347;OGQHCUYSWDOIMP-UHFFFAOYSA-N;AKOS015909428;2H-1-Benzopyran-3-carboxamide,7-(diethylamino)-N-[2-[(2-iodoacetyl)amino]ethyl]-2-oxo-;FT-0621394;n-[2-(iodoacetamido)ethyl]-7-diethylaminocoumarin-3-carboxamide;7-Diethylamino-3-((((2-iodoacetamido)ethyl)amino)carbonyl)coumarin(idcc);7-(Diethylamino)-N-[2-(2-iodoacetamido)ethyl]-2-oxo-2H-1-benzopyran-3-carboxamide;N-(2-{[7-(diethylamino)-2-oxo-2H-chromen-3-yl]formamido}ethyl)-2-iodoacetamide

Suppliers and Price of 7-Diethylamino-3-((((2-iodoacetamido)ethyl) amino)carbonyl)coumarin

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

American Custom Chemicals Corporation
7-DIETHYLAMINO-3-((((2-IODOACETAMIDO)ETHYL) AMINO)CARBONYL)COUMARIN 95.00%
5MG
$ 500.74

Total 3 raw suppliers

Chemical Property of 7-Diethylamino-3-((((2-iodoacetamido)ethyl) amino)carbonyl)coumarin

Chemical Property:

Vapor Pressure:1.81E-21mmHg at 25°C
Refractive Index:1.628
Boiling Point:735.1°Cat760mmHg
PKA:12.47±0.20(Predicted)
Flash Point:398.3°C
PSA：91.65000
Density:1.568g/cm³
LogP:2.70200
XLogP3:2.8
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:8
Exact Mass:471.06550
Heavy Atom Count:26
Complexity:563

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

7-DIETHYLAMINO-3-((((2-IODOACETAMIDO)ETHYL) AMINO)CARBONYL)COUMARIN 95.00% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCN(CC)C1=CC2=C(C=C1)C=C(C(=O)O2)C(=O)NCCNC(=O)CI

Technology Process of 7-Diethylamino-3-((((2-iodoacetamido)ethyl) amino)carbonyl)coumarin

There total 7 articles about 7-Diethylamino-3-((((2-iodoacetamido)ethyl) amino)carbonyl)coumarin 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:

: 160291-49-6
N-<2-(chloroacetamido)ethyl>-7-diethylamino-2-oxo-2H-chromene-3-carboxamide

: 160291-50-9
7-diethylamino-N-<2-(iodoacetamido)ethyl>-2-oxo-2H-chromene-3-carboxamide

Guidance literature:: With sodium iodide; In acetone; Ambient temperature;

Reference yield:

: 17754-90-4
4-(Diethylamino)salicylaldehyde

: 160291-50-9
7-diethylamino-N-<2-(iodoacetamido)ethyl>-2-oxo-2H-chromene-3-carboxamide

Guidance literature:: Multi-step reaction with 7 steps

1: 40 percent / piperidine / ethanol / 4 h / Heating

2: 90 percent / aq. NaOH / methanol / 0.08 h / Heating

3: tributylamine / dimethylformamide / 0.5 h / 0 - 5 °C

4: dimethylformamide / 3 h / Ambient temperature

5: trifluoroacetic acid / 1 h / Ambient temperature

6: Et₃N / CHCl₃ / 1 h / 0 - 5 °C

7: 0.59 g / NaI / acetone / Ambient temperature

With piperidine; sodium hydroxide; tributyl-amine; triethylamine; trifluoroacetic acid; sodium iodide; In methanol; ethanol; chloroform; N,N-dimethyl-formamide; acetone;

Reference yield:

: 28705-46-6
ethyl 7-diethylaminocoumarin-3-carboxylate

: 160291-50-9
7-diethylamino-N-<2-(iodoacetamido)ethyl>-2-oxo-2H-chromene-3-carboxamide

Guidance literature:: Multi-step reaction with 6 steps

1: 90 percent / aq. NaOH / methanol / 0.08 h / Heating

2: tributylamine / dimethylformamide / 0.5 h / 0 - 5 °C

3: dimethylformamide / 3 h / Ambient temperature

4: trifluoroacetic acid / 1 h / Ambient temperature

5: Et₃N / CHCl₃ / 1 h / 0 - 5 °C

6: 0.59 g / NaI / acetone / Ambient temperature

With sodium hydroxide; tributyl-amine; triethylamine; trifluoroacetic acid; sodium iodide; In methanol; chloroform; N,N-dimethyl-formamide; acetone;