2-(Pyrimidin-4-yl)malonaldehyde

Base Information

• Chemical Name: 2-(Pyrimidin-4-yl)malonaldehyde
• CAS No.: 28648-78-4
• Molecular Formula: C₇H₆N₂O₂
• Molecular Weight: 150.137
• Hs Code.: 29335995
• European Community (EC) Number: 674-210-1
• DSSTox Substance ID: DTXSID10397498
• Wikidata: Q82198907
• Mol file: 28648-78-4.mol

Synonyms:28648-78-4;2-(Pyrimidin-4-yl)malonaldehyde;2-(4-pyrimidyl)malondialdehyde;2-pyrimidin-4-ylpropanedial;2-(pyrimidin-4-yl)propanedial;4-pyrimidinylmalonaldehyde;3-HYDROXY-2-(PYRIMIDIN-4-YL)ACRYLALDEHYDE;SCHEMBL2554967;Propanedial,2-(4-pyrimidinyl)-;DTXSID10397498;2-(pyrimidin-4-yl)malondialdehyde;MFCD00216530;AKOS006220959;2-(1H-pyrimidin-6-ylidene)propanedial;FS-4567;SB56233;CS-0236629;FT-0653952;EN300-1720865;A819519

Chemical Property of 2-(Pyrimidin-4-yl)malonaldehyde

Chemical Property:

• Appearance/Colour: beige to beige-brownish powder
• Vapor Pressure: 0.00705mmHg at 25°C
• Melting Point: 227-232 °C
• Refractive Index: 1.525
• Boiling Point: 269.9 °C at 760 mmHg
• PKA: -1.35±0.10(Predicted)
• Flash Point: 121.1 °C
• PSA: 59.92000
• Density: 1.244 g/cm³
• LogP: -0.04200
• XLogP3: -0.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 150.042927438
• Heavy Atom Count: 11
• Complexity: 141

Purity/Quality:

99% ^*data from raw suppliers

2-(4-Pyrimidyl)malondialdehyde ^*data from reagent suppliers

Safty Information:

• Pictogram(s): C; Xi
• Hazard Codes: C,Xi
• Statements: 34-36
• Safety Statements: 45-36/37/39-25-26

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CN=CN=C1C(C=O)C=O

Technology Process of 2-(Pyrimidin-4-yl)malonaldehyde

There total 1 articles about 2-(Pyrimidin-4-yl)malonaldehyde 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-(4-pyrimidinyl)malondialdehyde (28648-78-4)

Guidance literature:

4-Methyl-pyrimidin, DMF, Phosgen;

Refernces