Ethyl 2-(4-methylpiperazin-1-yl)pyrimidine-5-carboxylate

Base Information

• Chemical Name: Ethyl 2-(4-methylpiperazin-1-yl)pyrimidine-5-carboxylate
• CAS No.: 1116339-74-2
• Molecular Formula: C12H18N4O2
• Molecular Weight: 250.29692
• Hs Code.: 29335990
• DSSTox Substance ID: DTXSID20705227
• Wikidata: Q82638012
• Mol file: 1116339-74-2.mol

Synonyms:Ethyl 2-(4-methylpiperazin-1-yl)pyrimidine-5-carboxylate;1116339-74-2;SCHEMBL15038302;DTXSID20705227;F81417;Ethyl2-(4-methylpiperazin-1-yl)pyrimidine-5-carboxylate

Chemical Property of Ethyl 2-(4-methylpiperazin-1-yl)pyrimidine-5-carboxylate

Chemical Property:

• Boiling Point: 393.3±52.0 °C(Predicted)
• PKA: 7.25±0.42(Predicted)
• PSA: 58.56000
• Density: 1.171±0.06 g/cm3(Predicted)
• LogP: 0.40800
• XLogP3: 0.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 4
• Exact Mass: 250.14297583
• Heavy Atom Count: 18
• Complexity: 271

Purity/Quality:

99% ^*data from raw suppliers

Ethyl2-(4-methylpiperazin-1-yl)pyrimidine-5-carboxylate 97% ^*data from reagent suppliers

Safty Information:

• Statements: 36/37/38
• Safety Statements: 26-36

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC(=O)C1=CN=C(N=C1)N2CCN(CC2)C