N-(2-Chloro-4-methylpentanoyl)-L-alanine
[CAS# 98880-39-8]

Identification

• Name: N-(2-Chloro-4-methylpentanoyl)-L-alanine
• Synonyms: (2S)-2-(2-chloro-4-methylpentanamido)propanoic acid
• Molecular Formula: C₉H₁₆ClNO₃
• Molecular Weight: 221.68
• CAS Registry Number: 98880-39-8
• SMILES: C[C@@H](C(=O)O)NC(=O)C(CC(C)C)Cl
• InChI: 1S/C9H16ClNO3/c1-5(2)4-7(10)8(12)11-6(3)9(13)14/h5-7H,4H2,1-3H3,(H,11,12)(H,13,14)/t6-,7?/m0/s1
• InChIKey: DRWSZYMFWYKWDP-PKPIPKONSA-N

Properties

• Density: 1.2±0.1g/cm³ (Cal.)
• Boiling point: 401.8±30.0°C at 760 mmHg (Cal.)
• Flash point: 196.8±24.6°C (Cal.)