07364

Butyl hexanoate

analytical standard

• Synonym(s): Butyl caproate, Hexanoic acid butyl ester, NSC 4022
• Linear Formula: CH₃(CH₂)₄CO₂(CH₂)₃CH₃
• CAS Number: 626-82-4
• Molecular Weight: 172.26
• EC Number: 210-964-6
• MDL number: MFCD00053804
• UNSPSC Code: 85151701
• PubChem Substance ID: 329748415
• NACRES: NA.24

Properties

• grade: analytical standard
• Quality Level: 100
• Assay: ≥98.5% (GC)
• shelf life: limited shelf life, expiry date on the label
• impurities: ≤1.0% water
• refractive index: n20/D 1.414-1.418; n20/D 1.416 (lit.)
• bp: 61-62 °C/3 mmHg (lit.)
• density: 0.866 g/mL at 25 °C (lit.)
• application(s): cleaning products; cosmetics; flavors and fragrances; food and beverages; personal care
• format: neat
• SMILES string: CCCCCC(=O)OCCCC
• InChI: 1S/C10H20O2/c1-3-5-7-8-10(11)12-9-6-4-2/h3-9H2,1-2H3
• InChI key: RPRPDTXKGSIXMD-UHFFFAOYSA-N

Safety Information

• Storage Class Code: 10 - Combustible liquids
• WGK: WGK 2
• Flash Point(F): 177.8 °F - closed cup
• Flash Point(C): 81 °C - closed cup