octyl (2S)-2-acetamido-4-methylsulfanyl-butanoate
[CAS# 94160-18-6]

Identification

• Name: octyl (2S)-2-acetamido-4-methylsulfanyl-butanoate
• Synonyms: octyl N-acetyl-DL-methionate
• Molecular Formula: C₁₅H₂₉NO₃S
• Molecular Weight: 303.46
• CAS Registry Number: 94160-18-6
• EINECS: 303-300-2
• SMILES: O=C(C)N[C@@H](CCSC)C(=O)OCCCCCCCC
• InChI: 1S/C15H29NO3S/c1-4-5-6-7-8-9-11-19-15(18)14(10-12-20-3)16-13(2)17/h14H,4-12H2,1-3H3,(H,16,17)/t14-/m0/s1
• InChIKey: IVEABYDAJLBAAJ-AWEZNQCLSA-N

Properties

• Density: 1.012g/cm³ (Cal.)
• Boiling point: 454.806°C at 760 mmHg (Cal.)
• Flash point: 228.859°C (Cal.)