02474

4-Methyl-2-pentanone

analytical standard

• Synonym(s): Isobutyl methyl ketone, Isopropylacetone, MIBK, Methyl isobutyl ketone
• Linear Formula: (CH₃)₂CHCH₂COCH₃
• CAS Number: 108-10-1
• Molecular Weight: 100.16
• UNSPSC Code: 41116107
• NACRES: NA.24
• PubChem Substance ID: 329747441
• EC Number: 203-550-1
• Beilstein/REAXYS Number: 605399
• MDL number: MFCD00008938

Properties

• grade: analytical standard
• Quality Level: 100
• vapor density: 3.5 (vs air)
• assay: ≥99.7% (GC)
• autoignition temp.: 840 °F
• shelf life: limited shelf life, expiry date on the label
• expl. lim.: 1.2-8 %, 93 °F
• technique(s): HPLC: suitable, gas chromatography (GC): suitable
• refractive index: n20/D 1.395 (lit.), n20/D 1.396
• bp: 117-118 °C
• mp: −80 °C (lit.)
• density: 0.801 g/mL at 25 °C (lit.)
• application(s): cleaning products; cosmetics; environmental; flavors and fragrances; food and beverages; personal care
• format: neat
• SMILES string: CC(C)CC(C)=O
• InChI: 1S/C6H12O/c1-5(2)4-6(3)7/h5H,4H2,1-3H3
• InChI key: NTIZESTWPVYFNL-UHFFFAOYSA-N

Description

General description

4-Methyl-2-pentanone (Methyl isobutyl ketone (MBK)) is an organic solvent widely used in various industrial applications, and exists as a clear colorless liquid with a pleasant odor. It is occasionally found as a volatile component of urine making it a biological marker of occupational exposure to this solvent. It is used as is used as a solvent for gums, resins, paints, varnishes, lacquers, and nitrocellulose.

Application

MBK may have been used as internal standard in GC/MS analysis for determining off-flavors in milk extracted using solid-phase microextraction, mass spectrometry, and multivariate analysis (SPME-MS-MVA). 4-Methyl-2-pentanone may be used as an analytical reference standard for the quantification of the analyte in hydro-alcoholic matrices using high-performance liquid chromatography with diode array detection.

Other Notes

Find a digital Reference Material for this product available on our online platform ChemisTwin® for NMR. You can use this digital equivalent on ChemisTwin® for your sample identity confirmation and compound quantification (with digital external standard). An NMR spectrum of this substance can be viewed and an online comparison against your sample can be performed with a few mouseclicks. Learn more here and start your free trial.

Safety Information

• pictograms: GHS02,GHS08,GHS07
• signalword: Danger
• hcodes: H225,H319,H332,H336,H351
• pcodes: P202 - P210 - P233 - P304 + P340 + P312 - P305 + P351 + P338 - P308 + P313
• Hazard Classifications: Acute Tox. 4 Inhalation - Carc. 2 Inhalation - Eye Irrit. 2 - Flam. Liq. 2 - STOT SE 3
• target_organs: Central nervous system
• supp_hazards: EUH066
• Storage Class: 3 - Flammable liquids
• wgk: WGK 1
• flash_point_f: 57.2 °F - closed cup
• flash_point_c: 14 °C - closed cup
• ppe: Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter