Sec-Butyl N-Methyl-N-(Trifluoroacetyl)-beta-Alaninate
[CAS# 54986-71-9]

Identification

• Name: Sec-Butyl N-Methyl-N-(Trifluoroacetyl)-beta-Alaninate
• Synonyms: Sec-butyl 3-[methyl(trifluoroacetyl)amino]propanoate #; β-Alanine, N-methyl-N-(trifluoroacetyl)-, 1-methylpropyl ester, (S)-
• Molecular Formula: C₁₀H₁₆F₃NO₃
• Molecular Weight: 255.23
• CAS Registry Number: 54986-71-9
• SMILES: FC(F)(F)C(=O)N(CCC(=O)OC(CC)C)C
• InChI: 1S/C10H16F3NO3/c1-4-7(2)17-8(15)5-6-14(3)9(16)10(11,12)13/h7H,4-6H2,1-3H3
• InChIKey: MECGQVNRUPNHJT-UHFFFAOYSA-N

Properties

• Density: 1.17g/cm³ (Cal.)
• Boiling point: 306.578°C at 760 mmHg (Cal.)
• Flash point: 139.214°C (Cal.)