59920

Isovalerophenone

≥98.0% (GC)

• Synonym(s): Isobutyl phenyl ketone
• Linear Formula: C₆H₅COCH₂CH(CH₃)₂
• CAS Number: 582-62-7
• Molecular Weight: 162.23
• Beilstein: 1861344
• EC Number: 209-489-7
• MDL number: MFCD00026486
• UNSPSC Code: 12352100
• PubChem Substance ID: 57651706
• NACRES: NA.22

Properties

• Assay: ≥98.0% (GC)
• refractive index: n20/D 1.512 (lit.); n20/D 1.512
• bp: 72-74 °C/3 mmHg (lit.)
• density: 0.966 g/mL at 25 °C (lit.)
• functional group: ketone; phenyl
• SMILES string: CC(C)CC(=O)c1ccccc1
• InChI: 1S/C11H14O/c1-9(2)8-11(12)10-6-4-3-5-7-10/h3-7,9H,8H2,1-2H3
• InChI key: HEOVGVNITGAUKL-UHFFFAOYSA-N

Safety Information

• Pictograms: GHS07
• Signal Word: Warning
• Hazard Statements: H315,H319,H335
• Precautionary Statements: P261 - P264 - P271 - P280 - P302 + P352 - P305 + P351 + P338
• Hazard Classifications: Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3
• Target Organs: Respiratory system
• Storage Class Code: 10 - Combustible liquids
• WGK: WGK 3
• Flash Point(F): 210.2 °F - closed cup
• Flash Point(C): 99 °C - closed cup
• Personal Protective Equipment: dust mask type N95 (US), Eyeshields, Gloves