2-Mercaptoethyl 3,5,5-Trimethylhexanoate
[CAS# 67859-58-9]

Identification

• Name: 2-Mercaptoethyl 3,5,5-Trimethylhexanoate
• Synonyms: 3,5,5-Trimethylhexanoic Acid 2-Mercaptoethyl Ester; 2-Mercaptoethyl 3,5,5-Trimethylhexanoate
• Molecular Formula: C₁₁H₂₂O₂S
• Molecular Weight: 218.35
• CAS Registry Number: 67859-58-9
• EINECS: 267-405-4
• SMILES: C(S)COC(=O)CC(C)CC(C)(C)C
• InChI: 1S/C11H22O2S/c1-9(8-11(2,3)4)7-10(12)13-5-6-14/h9,14H,5-8H2,1-4H3
• InChIKey: HCIZFLGIBDLOLH-UHFFFAOYSA-N

Properties

• Density: 0.957g/cm³ (Cal.)
• Boiling point: 274.533°C at 760 mmHg (Cal.)
• Flash point: 133.406°C (Cal.)