8-(2-Methoxy-4-(methylsulfinyl)phenyl)-1H-purine

Base Information

Chemical Name:8-(2-Methoxy-4-(methylsulfinyl)phenyl)-1H-purine
CAS No.:77456-53-2
Molecular Formula:C13H12N4O2S
Molecular Weight:288.325
Hs Code.:
DSSTox Substance ID:DTXSID60874401
ChEMBL ID:CHEMBL351198

Synonyms:8-(2-Methoxy-4-(methylsulfinyl)phenyl)-1H-purine;77456-53-2;1H-Purine, 8-(2-methoxy-4-(methylsulfinyl)phenyl)-;8-(2-Methoxy-4-methylsulfinyl-phenyl)-purin [German];8-(2-Methoxy-4-methylsulfinyl-phenyl)-purin;CHEMBL351198;SCHEMBL10765368;DTXSID60874401;VCYCFRKSFAXXOL-UHFFFAOYSA-N;LS-127106;8-(2-Methoxy-4-methylsulfinyl-phenyl)-purine

Suppliers and Price of 8-(2-Methoxy-4-(methylsulfinyl)phenyl)-1H-purine

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

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Chemical Property of 8-(2-Methoxy-4-(methylsulfinyl)phenyl)-1H-purine

Chemical Property:

Vapor Pressure:7.96E-14mmHg at 25°C
Boiling Point:588.4°Cat760mmHg
Flash Point:309.7°C
Density:1.51g/cm³
XLogP3:0.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:3
Exact Mass:288.06809681
Heavy Atom Count:20
Complexity:370

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:COC1=C(C=CC(=C1)S(=O)C)C2=NC3=NC=NC=C3N2

Technology Process of 8-(2-Methoxy-4-(methylsulfinyl)phenyl)-1H-purine

There total 7 articles about 8-(2-Methoxy-4-(methylsulfinyl)phenyl)-1H-purine 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: 80.0%

: 77456-44-1
8-(2-methoxy-4-methylthiophenyl)purine

: 77456-53-2
8-(2-methoxy-4-methylsulphinylphenyl)purine

Guidance literature:: With bromine; sodium acetate; acetic acid; at 20 - 23 ℃; for 1h;
DOI:10.1016/0223-5234(90)90141-O

Reference yield:

: 77456-44-1
8-(2-Methoxy-4-methylsulfanyl-phenyl)-9H-purine

: 77456-53-2
8-(2-methoxy-4-methylsulfinyl-phenyl)-purine

Guidance literature:: With 3-chloro-benzenecarboperoxoic acid; In ethanol; chloroform; at -40 - -30 ℃; for 3h;
DOI:10.1021/jm00383a006

Reference yield:

: 4093-29-2
methyl 4-(acetylamino)-o-anisate

: 77456-53-2
8-(2-methoxy-4-methylsulphinylphenyl)purine

Guidance literature:: Multi-step reaction with 5 steps

1: 87 percent / 10percent NaOH / 3 h / Heating

2: NaNO₂, HCl / H₂O / 0.5 h / 0 - 5 °C

3: 41 percent / Cu / 1.) from 0 deg C to 20 deg C, 3 h, 2.) RT, overnight

4: 35 percent / phosphoryl chloride / 4 h / Heating

5: 80 percent / sodium acetate, glacial acetic acid, bromine / 1 h / 20 - 23 °C

With hydrogenchloride; sodium hydroxide; bromine; sodium acetate; copper; acetic acid; sodium nitrite; trichlorophosphate; In water;
DOI:10.1016/0223-5234(90)90141-O