Phenethyl butyrate

• CAS: 103-52-6
• Catalog Number: ACM103526
• Category: Other Products
• Molecular Weight: 192.25
• Molecular Formula: C12H16O2
• Synonyms: Butanoic acid, 2-phenylethyl ester
• IUPAC Name: 2-Phenylethyl butanoate
• Canonical SMILES: CCCC(=O)OCCC1=CC=CC=C1
• InChI: InChI=1S/C12H16O2/c1-2-6-12(13)14-10-9-11-7-4-3-5-8-11/h3-5,7-8H,2,6,9-10H2,1H3
• InChI Key: WFNDDSQUKATKNX-UHFFFAOYSA-N
• Boiling Point: 260 °C
• Flash Point: >230 °F
• Density: 0.994 g/mL at 25 °C(lit.)
• Solubility: water, 44.15 mg/L @ 25 °C (est)
• Appearance: Colorless liquid; warm, floral and fruity odour
• Assay: 0.9999
• EC Number: 203-119-8
• Exact Mass: 192.115029749
• MDL Number: MFCD00048718
• Monoisotopic Mass: 192.115029749
• Packaging: 1 kg
• Physical State: Liquid
• Refractive Index: n20/D 1.49(lit.)
• Topological Polar Surface Area: 26.3 Ų