8-Amino-3-benzylhypoxanthine

Base Information

Chemical Name:8-Amino-3-benzylhypoxanthine
CAS No.:139460-96-1
Molecular Formula:C12H11 N5 O
Molecular Weight:241.252
Hs Code.:
DSSTox Substance ID:DTXSID90161053
Nikkaji Number:J481.020A
Wikidata:Q83029416
ChEMBL ID:CHEMBL35668
Mol file:139460-96-1.mol

Synonyms:8-ABHX;8-amino-3-benzylhypoxanthine

Suppliers and Price of 8-Amino-3-benzylhypoxanthine

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 8-Amino-3-benzylhypoxanthine

Chemical Property:

Vapor Pressure:3.45E-13mmHg at 25°C
Boiling Point:574.2°Cat760mmHg
Flash Point:301.1°C
PSA：90.32000
Density:1.51g/cm³
LogP:0.68020
XLogP3:0.8
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:241.09635999
Heavy Atom Count:18
Complexity:352

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC=C(C=C1)CN2C=NC(=O)C3=C2N=C(N3)N

Technology Process of 8-Amino-3-benzylhypoxanthine

There total 6 articles about 8-Amino-3-benzylhypoxanthine 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: 70.0%

: 139460-88-1
8-amino-3,9-dihydro-2-(methylthio)-3-(phenylmethyl)-6H-purin-6-one

: 139460-96-1
8-amino-3,9-dihydro-3-(phenylmethyl)-6H-purin-6-one

Guidance literature:: With sodium hydroxide; nickel; In ethanol; 2-methoxy-ethanol; at 65 ℃; for 4.3h;
DOI:10.1021/jm00086a014

Reference yield:

: 139460-79-0
6-amino-2-mercapto-5-nitroso-1-(phenylmethyl)-4(1H)-pyrimidinone

: 139460-96-1
8-amino-3,9-dihydro-3-(phenylmethyl)-6H-purin-6-one

Guidance literature:: Multi-step reaction with 5 steps

1: 73 percent / aq. NaOH / 15 h

2: 83 percent / Na₂S₂O₄ / 2-methoxy-ethanol; H₂O / 23 - 26 °C

3: 93 percent / 2-methoxy-ethanol / Ambient temperature

4: 89 percent / NH₃ / dimethylformamide

5: 70 percent / aq. sodium hydroxide / Raney Ni / 2-methoxy-ethanol; ethanol / 4.3 h / 65 °C

With sodium hydroxide; sodium dithionite; ammonia; nickel; In ethanol; 2-methoxy-ethanol; water; N,N-dimethyl-formamide;
DOI:10.1021/jm00086a014

Reference yield:

: 139460-87-0
5,6-diamino-2-(methylthio)-1-(phenylmethyl)-4(1H)-pyrimidinone

: 139460-96-1
8-amino-3,9-dihydro-3-(phenylmethyl)-6H-purin-6-one

Guidance literature:: Multi-step reaction with 3 steps

1: 93 percent / 2-methoxy-ethanol / Ambient temperature

2: 89 percent / NH₃ / dimethylformamide

3: 70 percent / aq. sodium hydroxide / Raney Ni / 2-methoxy-ethanol; ethanol / 4.3 h / 65 °C

With sodium hydroxide; ammonia; nickel; In ethanol; 2-methoxy-ethanol; N,N-dimethyl-formamide;
DOI:10.1021/jm00086a014