537462

Isopropyl acetate

≥99.6%

• Synonym(s): IPrOAc, Acetic acid isopropyl ester
• Linear Formula: CH₃COOCH(CH₃)₂
• CAS Number: 108-21-4
• Molecular Weight: 102.13
• Beilstein: 1740761
• EC Number: 203-561-1
• MDL number: MFCD00008877
• UNSPSC Code: 12352108
• PubChem Substance ID: 329757981
• NACRES: NA.21
• bp: 85-91 °C (lit.)
• vapor pressure: 47 mmHg ( 20 °C)

Properties

• vapor density: 3.5 (vs air)
• Quality Level: 200
• vapor pressure: 47 mmHg ( 20 °C)
• Assay: ≥99.6%
• form: liquid
• autoignition temp.: 894 °F
• expl. lim.: 1.8 %, 37 °F; 8 %
• impurities: ≤0.005% Acetic acid; ≤0.1% Water; ≤0.2% 2-Propanol
• refractive index: n20/D 1.377 (lit.)
• bp: 85-91 °C (lit.)
• mp: −73 °C (lit.)
• solubility: water: soluble 31.9 g/L at 20 °C
• density: 0.872 g/mL at 25 °C (lit.)
• SMILES string: CC(C)OC(C)=O
• InChI: 1S/C5H10O2/c1-4(2)7-5(3)6/h4H,1-3H3
• InChI key: JMMWKPVZQRWMSS-UHFFFAOYSA-N

Description

Application

Isopropyl acetate may be employed as a model oxygenate compound to evaluate the catalytic efficiency of La_0.8Sr_0.2MnO_3+x perovskite catalyst for the oxidation of various oxy-derivative compounds. It may be used as an extracting reagent for the N,N-dimethyl-2-[5-(cyanomethyl)-1H-indol-3-yl]ethylamine.

Other Notes

Pure-Pac^® II containers require the Micromatic MacroValve coupler for dispensing solvents, Z560723.

Legal Information

Pure-Pac is a registered trademark of Merck KGaA, Darmstadt, Germany

Safety Information

• Pictograms: GHS02,GHS07
• Signal Word: Danger
• Hazard Statements: H225,H319,H336
• Precautionary Statements: P210 - P233 - P240 - P241 - P242 - P305 + P351 + P338
• Hazard Classifications: Eye Irrit. 2 - Flam. Liq. 2 - STOT SE 3
• Target Organs: Central nervous system
• Supplementary Hazards: EUH066
• Storage Class Code: 3 - Flammable liquids
• WGK: WGK 1
• Flash Point(F): 41.0 °F - closed cup
• Flash Point(C): 5 °C - closed cup