2-Pyrimidinemethanol

Base Information

• Chemical Name: 2-Pyrimidinemethanol
• CAS No.: 42839-09-8
• Molecular Formula: C5H6N2O
• Molecular Weight: 110.115
• Hs Code.: 2933599090
• European Community (EC) Number: 824-123-1
• DSSTox Substance ID: DTXSID20376673
• Nikkaji Number: J1.928.833A
• Wikidata: Q72504870
• Mol file: 42839-09-8.mol

Synonyms:2-(Hydroxymethyl)pyrimidine;Pyrimidin-2-ylmethanol;

Chemical Property of 2-Pyrimidinemethanol

Chemical Property:

• Vapor Pressure: 0.225mmHg at 25°C
• Refractive Index: 1.557
• Boiling Point: 198.2 °C at 760 mmHg
• PKA: 13.61±0.10(Predicted)
• Flash Point: 73.7 °C
• PSA: 46.01000
• Density: 1.227 g/cm³
• LogP: -0.03110
• Storage Temp.: Sealed in dry,Room Temperature
• XLogP3: -0.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 110.048012819
• Heavy Atom Count: 8
• Complexity: 61.4

Purity/Quality:

98% ^*data from raw suppliers

2-Pyrimidinemethanol ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CN=C(N=C1)CO
• Uses: 2-?Pyrimidinemethanol is a reactant used in the synthesis of avanafil, which is used to treat erectile dysfunction. Also used in the synthesis of

Technology Process of 2-Pyrimidinemethanol

There total 6 articles about 2-Pyrimidinemethanol 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: 84.0%

pyrimidine-2-carboxylic acid methyl ester (34253-03-7) → 2-pyrimidinemethanol (42839-09-8)

Guidance literature:

With sodium tetrahydroborate; In ethanol; at 0 - 20 ℃; for 5h;

DOI:10.1039/d0nj02056g

Reference yield: 46.0%

→ sodium ethanolate (141-52-6) + 2-pyrimidinemethanol (42839-09-8)

Guidance literature:

Reference yield:

Dess-Martin periodinane + dichloromethane-methanolic ammonia + sodium thiosulfate → 2-pyrimidinemethanol (42839-09-8)

Guidance literature:

With sodium hydrogencarbonate; In acetic acid;

upstream raw materials:

(5-bromopyrimidine-2-yl)methanol

pyrimidine-2-carboxylic acid methyl ester

2-cyanopyrimidine

pyrimidine-2-carboxylic acid

Downstream raw materials:

(9H-Fluoren-9-yl)methyl (4-benzamido-5H-pyrrolo[3,2-d]pyrimidin-7-yl)methyl(1,3-dihydroxypropan-2-yl)carbamate

pyrimidine-2-carbaldehyde

C₁₇H₁₈Cl₂N₄O₂

2-((2-methylpyridin-4-yl)methyl)-4-(3,4,5-trimethoxyphenyl)-8-((pyrimidin-2-yl)methoxy)-1,2-dihydro-1-oxo-2,7-naphthyridine-3-carboxylic acid methyl ester

Refernces

• 1、 -. "COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH APJ RECEPTOR ACTIVITY". Page/Page column 171; 172. . Retrieved 2020/05/15.
• 2、 -. "COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH APJ RECEPTOR ACTIVITY". Page/Page column 115. . Retrieved 2019/09/18.