2-Phenylpyrimidin-5-amine

Base Information

• Chemical Name: 2-Phenylpyrimidin-5-amine
• CAS No.: 59808-52-5
• Molecular Formula: C10H9N3
• Molecular Weight: 171.19900
• Hs Code.: 2933599090
• European Community (EC) Number: 689-226-4
• DSSTox Substance ID: DTXSID50354909
• Wikidata: Q72498583
• Mol file: 59808-52-5.mol

Synonyms:2-phenylpyrimidin-5-amine;59808-52-5;5-Pyrimidinamine, 2-phenyl-;2-phenyl-5-aminopyrimidine;SCHEMBL40296;F2124-0470;DTXSID50354909;YUPYDSQWLFBBJJ-UHFFFAOYSA-N;HMS1772M02;MFCD00520252;STL480841;AKOS001219371;2-phenylpyrimidin-5-amine, AldrichCPR;SB57626;BS-13777;EN300-23860;E78577;Z166624374

Chemical Property of 2-Phenylpyrimidin-5-amine

Chemical Property:

• Vapor Pressure: 0.0274mmHg at 25°C
• Boiling Point: 246.2oC at 760 mmHg
• Flash Point: 126.1oC
• PSA: 51.80000
• Density: 1.193g/cm3
• LogP: 2.30700
• XLogP3: 1.5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 171.079647300
• Heavy Atom Count: 13
• Complexity: 146

Purity/Quality:

98%Min ^*data from raw suppliers

2-phenylpyrimidin-5-amine ^*data from reagent suppliers

Safty Information:

• Statements: 41
• Safety Statements: 26-39

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)C2=NC=C(C=N2)N

Technology Process of 2-Phenylpyrimidin-5-amine

There total 3 articles about 2-Phenylpyrimidin-5-amine 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:

2-phenyl-5-nitropyrimidine (68906-00-3) → 5-amino-2-phenylpyrimidine (59808-52-5)

Guidance literature:

With palladium on activated charcoal; ethanol; Hydrogenation;

DOI:10.1021/ja01588a045

Reference yield:

benzamidine monohydrochloride (1670-14-0) → 5-amino-2-phenylpyrimidine (59808-52-5)

Guidance literature:

Multi-step reaction with 2 steps

1: acetic acid anhydride

2: palladium/charcoal; ethanol / Hydrogenation

With palladium on activated charcoal; ethanol; acetic anhydride;

DOI:10.1021/ja01588a045

Reference yield:

→ 5-amino-2-phenylpyrimidine (59808-52-5)

Guidance literature:

5-Nitro-2-phenyl-pyrimidin, Hydrazin-hydrat (Pd-Kohle);

DOI:10.1039/j39680000836

upstream raw materials:

2-phenyl-5-nitropyrimidine

benzamidine monohydrochloride

Downstream raw materials:

N-(2-phenylpyrimidin-5-yl)benzamidine

(2-phenyl-pyrimidin-5-yl)-carbamic acid phenyl ester

N₁-methyl-N₁-(2-morpholinoethyl)-N₃-(2-((2-phenylpyrimidin-5-yl)carbamoyl)-4-(piperidin-1-yl)phenyl)isophthalamide

3-(3-((2-((2-phenylpyrimidin-5-yl)carbamoyl)-4-(piperidin-1-yl)phenyl)-carbamoyl)benzylthio)benzoic acid

Refernces

• 1、 Mikhaleva, M. A.,Lazareva, V. T.,Grebenkin, M.F.,Savel'ev, V. A.,Mamaev, V. P.. "SYNTHESIS OF SCHIFF BASES OF 2-SUBSTITUTED 5-AMINOPYRIMIDINES AND THEIR MESOMORPHIC PROPERTIES". . p. 1201 - 1208. Retrieved 2007/10/02.