Isopropyl tiglate

• CAS: 1733-25-1
• Catalog Number: ACM1733251
• Category: Other Products
• Molecular Weight: 142.2
• Molecular Formula: C8H14O2
• Synonyms: 3-Methylbut-2-enoic acid isopropyl ester
• IUPAC Name: Propan-2-yl (E)-2-methylbut-2-enoate
• Canonical SMILES: CC=C(C)C(=O)OC(C)C
• InChI: InChI=1S/C8H14O2/c1-5-7(4)8(9)10-6(2)3/h5-6H,1-4H3/b7-5+
• InChI Key: VUPBIVVRPJDWNW-FNORWQNLSA-N
• Boiling Point: 199.78 °C
• Flash Point: 123 °F
• Density: 0.896 g/mL at 25 °C(lit.)
• Solubility: Completely miscible with alcohol and diluted alcohol
• Appearance: Colorless clear liquid (est)
• Assay: 0.98
• EC Number: 217-067-9
• Exact Mass: 142.099379685
• Isomeric SMILES: C/C=C(\C)/C(=O)OC(C)C
• MDL Number: MFCD00016631
• Monoisotopic Mass: 142.099379685
• Packaging: 100 g
• Refractive Index: n20/D 1.431(lit.)
• Topological Polar Surface Area: 26.3 Ų