3,4,5,6-Tetrahydro-3-Butyl-2-(alpha-Ethoxybenzyl)-5-Methylpyrimidine
[CAS# 52963-63-0]

Identification

• Name: 3,4,5,6-Tetrahydro-3-Butyl-2-(alpha-Ethoxybenzyl)-5-Methylpyrimidine
• Synonyms: 1-Butyl-2-(Ethoxy-Phenyl-Methyl)-5-Methyl-5,6-Dihydro-4H-Pyrimidine; 3-Butyl-2-(Alpha-Ethoxybenzyl)-5-Methyl-3,4,5,6-Tetrahydropyrimidine; 5-23-11-00403 (Beilstein Handbook Reference)
• Molecular Formula: C₁₈H₂₈N₂O
• Molecular Weight: 288.43
• CAS Registry Number: 52963-63-0
• SMILES: C2=C(C(OCC)C1=NCC(CN1CCCC)C)C=CC=C2
• InChI: 1S/C18H28N2O/c1-4-6-12-20-14-15(3)13-19-18(20)17(21-5-2)16-10-8-7-9-11-16/h7-11,15,17H,4-6,12-14H2,1-3H3
• InChIKey: QPFCPBGIHZXRES-UHFFFAOYSA-N

Properties

• Density: 1.013g/cm³ (Cal.)
• Boiling point: 405.191°C at 760 mmHg (Cal.)
• Flash point: 198.853°C (Cal.)