1H-Purine-2,6-dione, 3,7-dihydro-3-(cyclohexylmethyl)-1-methyl-

Base Information

Chemical Name:1H-Purine-2,6-dione, 3,7-dihydro-3-(cyclohexylmethyl)-1-methyl-
CAS No.:132560-03-3
Molecular Formula:C₁₃H₁₈N₄O₂
Molecular Weight:262.312
Hs Code.:
DSSTox Substance ID:DTXSID80157622
Nikkaji Number:J361.817J
Wikidata:Q83025778

Synonyms:BRN 4200222;Xanthine, 3-(cyclohexylmethyl)-1-methyl-;1H-Purine-2,6-dione, 3,7-dihydro-3-(cyclohexylmethyl)-1-methyl-;3,7-Dihydro-3-(cyclohexylmethyl)-1-methyl-1H-purine-2,6-dione;132560-03-3;DTXSID80157622;1-Methyl-3-(cyclohexylmethyl)xanthine;LS-126671

Suppliers and Price of 1H-Purine-2,6-dione, 3,7-dihydro-3-(cyclohexylmethyl)-1-methyl-

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
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price

Total 1 raw suppliers

Chemical Property of 1H-Purine-2,6-dione, 3,7-dihydro-3-(cyclohexylmethyl)-1-methyl-

Chemical Property:

Vapor Pressure:2.94E-10mmHg at 25°C
Boiling Point:503.3°C at 760 mmHg
Flash Point:258.2°C
Density:1.292g/cm³
XLogP3:2.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:262.14297583
Heavy Atom Count:19
Complexity:381

Purity/Quality:: 99% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CN1C(=O)C2=C(N=CN2)N(C1=O)CC3CCCCC3

Technology Process of 1H-Purine-2,6-dione, 3,7-dihydro-3-(cyclohexylmethyl)-1-methyl-

There total 3 articles about 1H-Purine-2,6-dione, 3,7-dihydro-3-(cyclohexylmethyl)-1-methyl- 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:

: 132560-23-7
1-Cyclohexylmethyl-3-methyl-urea

: 132560-03-3
3-Cyclohexylmethyl-1-methyl-3,7-dihydro-purine-2,6-dione

Guidance literature:: Multi-step reaction with 4 steps

1: 1.) acetic anhydride, 2.) 10percent aq. NaOH / 1.) 70 deg C, 2 h, 2.) from 20 to 70 deg C, 1 h

2: NaNO₂, AcOH / H₂O / 2 h / Ambient temperature

3: Na₂S₂O₄, 25percent aq. NH₄OH / 20 - 50 °C

4: 2.) 2.2 M aq. NaOH / 1.) reflux, 2 h, 2.) reflux, 45 min

With ammonium hydroxide; sodium hydroxide; sodium dithionite; acetic anhydride; acetic acid; sodium nitrite; In water;
DOI:10.1016/0223-5234(90)90130-U

Reference yield:

: 132560-25-9
6-Amino-1-cyclohexylmethyl-3-methyl-1H-pyrimidine-2,4-dione

: 132560-03-3
3-Cyclohexylmethyl-1-methyl-3,7-dihydro-purine-2,6-dione

Guidance literature:: Multi-step reaction with 3 steps

1: NaNO₂, AcOH / H₂O / 2 h / Ambient temperature

2: Na₂S₂O₄, 25percent aq. NH₄OH / 20 - 50 °C

3: 2.) 2.2 M aq. NaOH / 1.) reflux, 2 h, 2.) reflux, 45 min

With ammonium hydroxide; sodium hydroxide; sodium dithionite; acetic acid; sodium nitrite; In water;
DOI:10.1016/0223-5234(90)90130-U

Reference yield:

: 132560-29-3
6-Amino-1-cyclohexylmethyl-3-methyl-5-nitroso-1H-pyrimidine-2,4-dione

: 132560-03-3
3-Cyclohexylmethyl-1-methyl-3,7-dihydro-purine-2,6-dione

Guidance literature:: Multi-step reaction with 2 steps

1: Na₂S₂O₄, 25percent aq. NH₄OH / 20 - 50 °C

2: 2.) 2.2 M aq. NaOH / 1.) reflux, 2 h, 2.) reflux, 45 min

With ammonium hydroxide; sodium hydroxide; sodium dithionite;
DOI:10.1016/0223-5234(90)90130-U