Benzoic acid, 4-((2,4-diamino-5-pyrimidinyl)methyl)-2,6-dimethoxy-

Base Information

Chemical Name:Benzoic acid, 4-((2,4-diamino-5-pyrimidinyl)methyl)-2,6-dimethoxy-
CAS No.:55687-45-1
Molecular Formula:C14H16N4O4
Molecular Weight:304.3012
Hs Code.:
DSSTox Substance ID:DTXSID40204207
Wikidata:Q83077656

Synonyms:BRN 0897518;Benzoic acid, 4-((2,4-diamino-5-pyrimidinyl)methyl)-2,6-dimethoxy-;55687-45-1;alpha-(2,4-Diamino-5-pyrimidinyl)-2,6-dimethoxy-p-toluic acid;4-((2,4-Diamino-5-pyrimidinyl)methyl)-2,6-dimethoxybenzoic acid;SCHEMBL11849244;DTXSID40204207;LS-36747

Suppliers and Price of Benzoic acid, 4-((2,4-diamino-5-pyrimidinyl)methyl)-2,6-dimethoxy-

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 1 raw suppliers

Chemical Property of Benzoic acid, 4-((2,4-diamino-5-pyrimidinyl)methyl)-2,6-dimethoxy-

Chemical Property:

Vapor Pressure:8.61E-16mmHg at 25°C
Boiling Point:611.2°C at 760 mmHg
Flash Point:323.4°C
Density:1.38g/cm³
XLogP3:-0.2
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:5
Exact Mass:304.11715500
Heavy Atom Count:22
Complexity:370

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

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:COC1=CC(=CC(=C1C(=O)O)OC)CC2=CN=C(N=C2N)N

Technology Process of Benzoic acid, 4-((2,4-diamino-5-pyrimidinyl)methyl)-2,6-dimethoxy-

There total 7 articles about Benzoic acid, 4-((2,4-diamino-5-pyrimidinyl)methyl)-2,6-dimethoxy- 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: 67.0%

: 55687-40-6
methyl α-(2,4-diamino-5-pyrimidinyl)-2,6-dimethoxy-p-toluate

: 55687-45-1
α-(2,4-diamino-5-pyrimidinyl)-2,6-dimethoxy-p-toluic acid

Guidance literature:: With dimethyl amine; In methanol; water; at 160 ℃; for 16h;

Reference yield:

: α-(2,4-diamino-5-pyrimidinyl)-2,6-dimethoxy-p-tolylbenzoic acid methyl ester

: 55687-45-1
α-(2,4-diamino-5-pyrimidinyl)-2,6-dimethoxy-p-toluic acid

Guidance literature:: With sodium hydroxide; In ethanol; water;

Reference yield:

: 33187-98-3
3,5-dimethoxy-4-(methoxycarbonyl)benzaldehyde

: 55687-45-1
α-(2,4-diamino-5-pyrimidinyl)-2,6-dimethoxy-p-toluic acid

Guidance literature:: Multi-step reaction with 4 steps

1: 81 percent / sodium methylate / dimethylformamide / 0.25 h / 75 °C

2: 95 percent / propan-2-ol / 0.5 h / Heating

3: 86 percent / sodium methylate / ethanol / 40 h / Heating

4: 67 percent / dimethylamine / methanol; H₂O / 16 h / 160 °C

With sodium methylate; dimethyl amine; In methanol; ethanol; water; N,N-dimethyl-formamide; isopropyl alcohol;