N-[(5-Ethynyl-2-thienyl)carbonyl]-2-methylalanine
[CAS# 919098-98-9]

Identification

• Name: N-[(5-Ethynyl-2-thienyl)carbonyl]-2-methylalanine
• Synonyms: 2-(5-ethynylthiophene-2-carboxamido)-2-methylpropanoic acid; ALANINE, N-[(5-ETHYNYL-2-THIENYL)CARBONYL]-2-METHYL-
• Molecular Formula: C₁₁H₁₁NO₃S
• Molecular Weight: 237.27
• CAS Registry Number: 919098-98-9
• SMILES: CC(C)(C(=O)O)NC(=O)c1ccc(s1)C#C
• InChI: 1S/C11H11NO3S/c1-4-7-5-6-8(16-7)9(13)12-11(2,3)10(14)15/h1,5-6H,2-3H3,(H,12,13)(H,14,15)
• InChIKey: WVKZGFFUUAUJQV-UHFFFAOYSA-N

Properties

• Density: 1.322g/cm³ (Cal.)
• Boiling point: 452.751°C at 760 mmHg (Cal.)
• Flash point: 227.616°C (Cal.)
• Refractive index: 1.59 (Cal.)