112992

Isopropyl acetate

98%

• Synonym(s): 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: 329749351
• NACRES: NA.21

Properties

• vapor density: 3.5 (vs air)
• Quality Level: 100
• vapor pressure: 47 mmHg ( 20 °C)
• Assay: 98%
• form: liquid
• autoignition temp.: 894 °F
• expl. lim.: 1.8 %, 37 °F; 8 %
• greener alternative product characteristics: Safer Solvents and Auxiliaries; Learn more about the Principles of Green Chemistry.
• sustainability: Greener Alternative Product
• refractive index: n20/D 1.377 (lit.)
• bp: 85-91 °C (lit.)
• mp: −73 °C (lit.)
• density: 0.872 g/mL at 25 °C (lit.)
• greener alternative category: , Aligned
• 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

General description

Isopropyl acetate is an isopropyl ester of acetic acid. It participates in the mesoporous Al-MCM-41 (Si/Al = 55 and 104) and Al, Zn-MCM-41 (Si/(Al+Zn) = 52) molecular sieves catalyzed alkylation of m-cresol. It is widely used for the incorporation of aroma to various cosmetics and food products. Vapor-liquid equilibria for its binary mixture with CO₂ at higher pressures has been evaluated.

We are committed to bringing you Greener Alternative Products, which adhere to one or more of The 12 Principles of Green Chemistry. This product has been enhanced for "Safer Solvents and Auxiliaries". Click here for more information.

Application

Isopropyl acetate may be employed as 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 extracting reagent for the N,N-dimethyl-2-[5-(cyanomethyl)-1H-indol-3-yl]ethylamine.

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