Methyl 4-methylpyrimidine-5-carboxylate

Base Information

• Chemical Name: Methyl 4-methylpyrimidine-5-carboxylate
• CAS No.: 157335-94-9
• Molecular Formula: C₇H₈N₂O₂
• Molecular Weight: 152.153
• DSSTox Substance ID: DTXSID60565463
• Nikkaji Number: J3.662.929K
• Wikidata: Q72496989
• Mol file: 157335-94-9.mol

Synonyms:methyl 4-methylpyrimidine-5-carboxylate;157335-94-9;4-METHYL-5-PYRIMIDINECARBOXYLIC ACID METHYL ESTER;5-pyrimidinecarboxylicacid,4-methyl-,methylester(9ci);methyl4-methylpyrimidine-5-carboxylate;SCHEMBL22791669;DTXSID60565463;AMY31870;AKOS015866694;SB56566;EN300-127259;Z795669894

Chemical Property of Methyl 4-methylpyrimidine-5-carboxylate

Chemical Property:

• Refractive Index: 1.512
• Boiling Point: 234.218 °C at 760 mmHg
• PKA: 0.20±0.16(Predicted)
• Flash Point: 95.452 °C
• PSA: 52.08000
• Density: 1.17 g/cm³
• LogP: 0.57160
• XLogP3: 0.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 152.058577502
• Heavy Atom Count: 11
• Complexity: 149

Purity/Quality:

99% ^*data from raw suppliers

methyl4-methylpyrimidine-5-carboxylate ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=NC=NC=C1C(=O)OC

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