2-Hydroxy-2-(1-Hydroxyethyl)-3-Methylpentanoic Acid [[5,6,7,7a-Tetrahydro-3H-Pyrrolizin]-1-Ylmethyl] Ester
[CAS# 84306-92-3]

Identification

• Name: 2-Hydroxy-2-(1-Hydroxyethyl)-3-Methylpentanoic Acid [[5,6,7,7a-Tetrahydro-3H-Pyrrolizin]-1-Ylmethyl] Ester
• Synonyms: 5,6,7,8-Tetrahydro-3H-Pyrrolizin-1-Ylmethyl 2-Hydroxy-2-(1-Hydroxyethyl)-3-Methyl-Pentanoate; 2-Hydroxy-2-(1-Hydroxyethyl)-3-Methylpentanoic Acid 5,6,7,8-Tetrahydro-3H-Pyrrolizin-1-Ylmethyl Ester; 2-Hydroxy-2-(1-Hydroxyethyl)-3-Methyl-Valeric Acid 5,6,7,8-Tetrahydro-3H-Pyrrolizin-1-Ylmethyl Ester
• Molecular Formula: C₁₆H₂₇NO₄
• Molecular Weight: 297.39
• CAS Registry Number: 84306-92-3
• SMILES: C(C1=CCN2C1CCC2)OC(C(C(O)C)(C(CC)C)O)=O
• InChI: 1S/C16H27NO4/c1-4-11(2)16(20,12(3)18)15(19)21-10-13-7-9-17-8-5-6-14(13)17/h7,11-12,14,18,20H,4-6,8-10H2,1-3H3
• InChIKey: WNDKUMUAOQFAGL-UHFFFAOYSA-N

Properties

• Density: 1.168g/cm³ (Cal.)
• Boiling point: 429.359°C at 760 mmHg (Cal.)
• Flash point: 213.469°C (Cal.)