3-[2-Hydroxy-3-[4-(2-Hydroxyethyl)-1-Piperazinyl]Propoxy]-p-Cymene-2-Carboxylic Acid Methyl Ester
[CAS# 53335-20-9]

Identification

• Name: 3-[2-Hydroxy-3-[4-(2-Hydroxyethyl)-1-Piperazinyl]Propoxy]-p-Cymene-2-Carboxylic Acid Methyl Ester
• Synonyms: Methyl 2-[2-Hydroxy-3-[4-(2-Hydroxyethyl)Piperazin-1-Yl]Propoxy]-3-Isopropyl-6-Methyl-Benzoate; 2-[2-Hydroxy-3-[4-(2-Hydroxyethyl)-1-Piperazinyl]Propoxy]-3-Isopropyl-6-Methylbenzoic Acid Methyl Ester; 2-[2-Hydroxy-3-[4-(2-Hydroxyethyl)Piperazin-1-Yl]Propoxy]-3-Isopropyl-6-Methyl-Benzoic Acid Methyl Ester
• Molecular Formula: C₂₁H₃₄N₂O₅
• Molecular Weight: 394.51
• CAS Registry Number: 53335-20-9
• SMILES: C1=C(C(=C(C(=C1)C)C(OC)=O)OCC(CN2CCN(CC2)CCO)O)C(C)C
• InChI: 1S/C21H34N2O5/c1-15(2)18-6-5-16(3)19(21(26)27-4)20(18)28-14-17(25)13-23-9-7-22(8-10-23)11-12-24/h5-6,15,17,24-25H,7-14H2,1-4H3
• InChIKey: ACFSLNOJYWCHEO-UHFFFAOYSA-N

Properties

• Density: 1.133g/cm³ (Cal.)
• Boiling point: 549.855°C at 760 mmHg (Cal.)
• Flash point: 286.342°C (Cal.)