1,3-diethyl-8-[(E)-2-(2-fluorophenyl)ethenyl]-7H-purine-2,6-dione

Base Information

Chemical Name:1,3-diethyl-8-[(E)-2-(2-fluorophenyl)ethenyl]-7H-purine-2,6-dione
CAS No.:155271-90-2
Molecular Formula:C₁₇H₁₇FN₄O₂
Molecular Weight:328.346
Hs Code.:
Wikidata:Q76389491
Mol file:155271-90-2.mol

Synonyms:155271-90-2;1,3-diethyl-8-[(E)-2-(2-fluorophenyl)ethenyl]-7H-purine-2,6-dione;(E)-1,3-Diethyl-8-(2-fluorostyryl)xanthine;(E)-1,3-Diethyl-8-(2-(2-fluorophenyl)ethenyl)-3,7-dihydro-1H-purine-2,6-dione;1H-Purine-2,6-dione, 3,7-dihydro-1,3-diethyl-8-(2-(2-fluorophenyl)ethenyl)-, (E)-;1H-Purine-2,6-dione, 3,7-dihydro-1,3-diethyl-8-(2-(2-fluorophenyl)ethe nyl)-, (E)-;SCHEMBL7307763;SCHEMBL7307772;LS-126725

Suppliers and Price of 1,3-diethyl-8-[(E)-2-(2-fluorophenyl)ethenyl]-7H-purine-2,6-dione

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
(E)-3,7-DIHYDRO-1,3-DIETHYL-8-(2-(2-FLUOROPHENYL)ETHENYL)-1H-PURINE-2,6-DIONE 95.00%
5MG
$ 502.21

Total 0 raw suppliers

Chemical Property of 1,3-diethyl-8-[(E)-2-(2-fluorophenyl)ethenyl]-7H-purine-2,6-dione

Chemical Property:

Vapor Pressure:2.39E-12mmHg at 25°C
Boiling Point:554.8°Cat760mmHg
PKA:7.83±0.70(Predicted)
Flash Point:289.3°C
PSA：72.68000
Density:1.337g/cm³
LogP:2.23560
XLogP3:3.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:328.13355396
Heavy Atom Count:24
Complexity:527

Purity/Quality:: (E)-3,7-DIHYDRO-1,3-DIETHYL-8-(2-(2-FLUOROPHENYL)ETHENYL)-1H-PURINE-2,6-DIONE 95.00% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCN1C2=C(C(=O)N(C1=O)CC)NC(=N2)C=CC3=CC=CC=C3F
Isomeric SMILES:CCN1C2=C(C(=O)N(C1=O)CC)NC(=N2)/C=C/C3=CC=CC=C3F

Technology Process of 1,3-diethyl-8-[(E)-2-(2-fluorophenyl)ethenyl]-7H-purine-2,6-dione

There total 2 articles about 1,3-diethyl-8-[(E)-2-(2-fluorophenyl)ethenyl]-7H-purine-2,6-dione 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: 41.0%