Octadecyl 2-Methyl-3-Tridecylsulfanylpropanoate
[CAS# 36994-36-2]

Identification

• Name: Octadecyl 2-Methyl-3-Tridecylsulfanylpropanoate
• Synonyms: Octadecyl 2-Methyl-3-Tridecylsulfanyl-Propanoate; 2-Methyl-3-(Tridecylthio)Propanoic Acid Octadecyl Ester; 2-Methyl-3-(Tridecylthio)Propionic Acid Stearyl Ester
• Molecular Formula: C₃₅H₇₀O₂S
• Molecular Weight: 555.00
• CAS Registry Number: 36994-36-2
• EINECS: 253-302-1
• SMILES: C(SCCCCCCCCCCCCC)C(C(OCCCCCCCCCCCCCCCCCC)=O)C
• InChI: 1S/C35H70O2S/c1-4-6-8-10-12-14-16-17-18-19-20-21-23-25-27-29-31-37-35(36)34(3)33-38-32-30-28-26-24-22-15-13-11-9-7-5-2/h34H,4-33H2,1-3H3
• InChIKey: CUFPJSAZAYYDAT-UHFFFAOYSA-N

Properties

• Density: 0.889g/cm³ (Cal.)
• Boiling point: 609.839°C at 760 mmHg (Cal.)
• Flash point: 274.592°C (Cal.)