2-Isobutyl-4-methylthiazole

• CAS: 61323-24-8
• Catalog Number: ACM61323248
• Category: Other Products
• Molecular Weight: 155.26
• Molecular Formula: C₈H₁₃NS
• Synonyms: Thiazole, 2-isobutyl-4-methyl
• IUPAC Name: 4-Methyl-2-(2-methylpropyl)-1,3-thiazole
• Canonical SMILES: CC1=CSC(=N1)CC(C)C
• InChI: InChI=1S/C8H13NS/c1-6(2)4-8-9-7(3)5-10-8/h5-6H,4H2,1-3H3
• InChI Key: JBUCYVMFLWLDIO-UHFFFAOYSA-N
• Boiling Point: 189 °C
• Density: 0.979 g/mL at 25 °C(lit.)
• Exact Mass: 155.07687059
• Monoisotopic Mass: 155.07687059
• Refractive Index: n20/D 1.4930-1.4950(lit.)
• Topological Polar Surface Area: 41.1 Ų