Isopropyl acetate
SIAL/90871 - analytical standard
Synonym: Acetic acid isopropyl ester
CAS Number: 108-21-4
Empirical Formula (Hill Notation): C5H10O2
Molecular Weight: 102.13
EC Number: 203-561-1
MDL Number: MFCD00008877
Linear Formula: CH3COOCH(CH3)2
Product Type: Chemical
| application(s) | cleaning products cosmetics environmental flavors and fragrances food and beverages personal care |
| assay | ≥99.8% (GC) |
| autoignition temp. | 894 °F |
| bp | 85-91 °C (lit.) |
| density | 0.872 g/mL at 25 °C (lit.) |
| expl. lim. | 1.8 %, 37 °F |
| 8 % | |
| format | neat |
| grade | analytical standard |
| InChI | 1S/C5H10O2/c1-4(2)7-5(3)6 |
| InChI key | JMMWKPVZQRWMSS-UHFFFAOYSA |
| mp | −73 °C (lit.) |
| Quality Level | 100  |
| refractive index | n |
| n |
|
| shelf life | limited shelf life, expiry date on the label |
| SMILES string | CC(C)OC(C)=O |
| technique(s) | gas chromatography (GC): suitable |
| HPLC: suitable | |
| vapor density | 3.5 (vs air) |
| vapor pressure | 47 mmHg ( 20 °C) |
| Application: | Isopropyl acetate may be employed as model oxygenate compound to evaluate the catalytic efficiency of La0.8Sr0.2MnO3+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-(cyanometh |
| Application: | Isopropyl acetate may be used as an analytical standard for the determination of the analyte in water samples and organic solvent mixtures by various gas chromatography (GC) techniques. |
| Application: | Refer to the product′s Certificate of Analysis for more information on a suitable instrument technique. Contact Technical Service for further support. |
| 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. It is a colorless, flammable liquid, having a pleasant fruity type of odor. |
| Recommended products: | 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 . |
| Symbol |   GHS02,GHS07 |
| Signal word | Danger |
| Hazard statements | H225 - H319 - H336 |
| Precautionary statements | P210 - P233 - P240 - P241 - P242 - P305 + P351 + P338 |
| Hazard Codes | F,Xi |
| Risk Statements | 11-36-66-67 |
| Safety Statements | 16-26-29-33 |
| RIDADR | UN1220 - class 3 - PG 2 - Isopropyl acetate |
| WGK Germany | WGK 1 |
| Flash Point(F) | 41.0 °F |
| Flash Point(C) | 5 °C |
| Supplemental Hazard Statements | EUH066 |
| Purity | ≥99.8% (GC) |
| bp | 85-91 °C (lit.) |
| mp | −73 °C (lit.) |
| Density | 0.872 g/mL at 25 °C (lit.) |
| Refractive Index | n |
| UNSPSC | 85151701 |