Monoerucin
[CAS# 28063-42-5]

Identification

• Name: Monoerucin
• Synonyms: [2-Hydroxy-1-(Hydroxymethyl)Ethyl] (Z)-Docos-13-Enoate; (Z)-Docos-13-Enoic Acid [2-Hydroxy-1-(Hydroxymethyl)Ethyl] Ester; (Z)-Docos-13-Enoic Acid (2-Hydroxy-1-Methylol-Ethyl) Ester
• Molecular Formula: C₂₅H₄₈O₄
• Molecular Weight: 412.65
• CAS Registry Number: 28063-42-5
• EINECS: 248-812-6
• SMILES: C(C(OC(CO)CO)=O)CCCCCCCCCC\C=C/CCCCCCCC
• InChI: 1S/C25H48O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-25(28)29-24(22-26)23-27/h9-10,24,26-27H,2-8,11-23H2,1H3/b10-9-
• InChIKey: TZDOBCZHGBGJLS-KTKRTIGZSA-N

Properties

• Density: 0.951g/cm³ (Cal.)
• Boiling point: 533.272°C at 760 mmHg (Cal.)
• Flash point: 165.156°C (Cal.)