3-(N-Phenylamino)-1,2-Propanediol 1-Oleoyl Ester
[CAS# 102390-02-3]

Identification

• Name: 3-(N-Phenylamino)-1,2-Propanediol 1-Oleoyl Ester
• Synonyms: (E)-Octadec-9-Enoic Acid [2-Hydroxy-3-(Phenylamino)Propyl] Ester; 3-(N-Phenylamino)-1,2-Propanediol 1-Oleoyl Ester; 9-Octadecenoic Acid (Z)-, 2-Hydroxy-3-(Phenylamino)Propyl Ester
• Molecular Formula: C₂₇H₄₅NO₃
• Molecular Weight: 431.66
• CAS Registry Number: 102390-02-3
• SMILES: C1=C(NCC(COC(CCCCCCC/C=C/CCCCCCCC)=O)O)C=CC=C1
• InChI: 1S/C27H45NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-19-22-27(30)31-24-26(29)23-28-25-20-17-16-18-21-25/h9-10,16-18,20-21,26,28-29H,2-8,11-15,19,22-24H2,1H3/b10-9+
• InChIKey: ZSQHZTSVIIYJNV-MDZDMXLPSA-N

Properties

• Density: 0.995g/cm³ (Cal.)
• Boiling point: 569.365°C at 760 mmHg (Cal.)
• Flash point: 298.141°C (Cal.)