7-Allyl-8-amino-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione

Base Information

Chemical Name:7-Allyl-8-amino-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
CAS No.:135574-30-0
Molecular Formula:C₁₀H₁₃N₅O₂
Molecular Weight:235.246
Hs Code.:
DSSTox Substance ID:DTXSID30354982
Nikkaji Number:J362.485D
Wikidata:Q82133523
Mol file:135574-30-0.mol

Synonyms:135574-30-0;7-ALLYL-8-AMINO-1,3-DIMETHYL-3,7-DIHYDRO-1H-PURINE-2,6-DIONE;BAS 02080951;8-amino-1,3-dimethyl-7-prop-2-enylpurine-2,6-dione;CHEMBRDG-BB 9070946;Oprea1_112714;DTXSID30354982;7-Allyl-8-amino-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione;HMS1680C15;MFCD02984432;STL329469;AKOS000722207;8-amino-1,3-dimethyl-7-(prop-2-en-1-yl)-2,3,6,7-tetrahydro-1H-purine-2,6-dione;BS-36621;SR-01000361751;SR-01000361751-1;Z223825182;8-amino-1,3-dimethyl-7-(prop-2-en-1-yl)-3,7-dihydro-1H-purine-2,6-dione

Suppliers and Price of 7-Allyl-8-amino-1,3-dimethyl-3,7-dihydro-1H-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

Total 2 raw suppliers

Chemical Property of 7-Allyl-8-amino-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione

Chemical Property:

Vapor Pressure:9.41E-09mmHg at 25°C
Boiling Point:463°C at 760 mmHg
Flash Point:233.8°C
Density:1.44g/cm³
XLogP3:0
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:235.10692467
Heavy Atom Count:17
Complexity:372

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)N)CC=C

Technology Process of 7-Allyl-8-amino-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione

There total 5 articles about 7-Allyl-8-amino-1,3-dimethyl-3,7-dihydro-1H-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: 34.0%

: 135574-35-5
7-Allyl-8-nitro-1,3-dimethylxanthine

: 135574-30-0
7-Allyl-8-amino-1,3-dimethylxanthine

Guidance literature:: With sodium disulfite; In water; at 80 - 90 ℃; for 2h;
DOI:10.1248/cpb.39.270

Reference yield:

: 2099-73-2
8-nitrotheophylline

: 135574-30-0
7-Allyl-8-amino-1,3-dimethylxanthine

Guidance literature:: Multi-step reaction with 2 steps

1: 1.) sodium hydride / 1.) DMF, mineral oil, 90 deg C, 2.) 90 deg C, 3 h

2: 34 percent / sodium hydrosulfite / H₂O / 2 h / 80 - 90 °C

With sodium disulfite; sodium hydride; In water;
DOI:10.1248/cpb.39.270

Reference yield:

: 19410-53-8
8-aminotheophylline

: 106-95-6
allyl bromide

: 135574-30-0
7-Allyl-8-amino-1,3-dimethylxanthine

Guidance literature:: With sodium hydride; Yield given. Multistep reaction; 1.) DMF, mineral oil, 90 deg C, 2.) r.t., 3 h;
DOI:10.1248/cpb.39.270