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Merck

537462

Sigma-Aldrich

Isopropyl acetate

≥99.6%

Sinónimos:

IPrOAc, Acetic acid isopropyl ester

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About This Item

Fórmula lineal:
CH3COOCH(CH3)2
Número de CAS:
Peso molecular:
102.13
Beilstein/REAXYS Number:
1740761
EC Number:
MDL number:
UNSPSC Code:
12352108
PubChem Substance ID:
NACRES:
NA.21

vapor density

3.5 (vs air)

Quality Level

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

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Application

Isopropyl acetate may be employed as a 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 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

pictograms

FlameExclamation mark

signalword

Danger

Hazard Classifications

Eye Irrit. 2 - Flam. Liq. 2 - STOT SE 3

target_organs

Central nervous system

supp_hazards

Storage Class

3 - Flammable liquids

wgk_germany

WGK 1

flash_point_f

41.0 °F - closed cup

flash_point_c

5 °C - closed cup


Certificados de análisis (COA)

Busque Certificados de análisis (COA) introduciendo el número de lote del producto. Los números de lote se encuentran en la etiqueta del producto después de las palabras «Lot» o «Batch»

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Heats of combustion and formation of ethyl acetate and isopropyl acetate.
Butwill ME and Rockenfeller JD.
Thermochimica Acta, 1(3), 289-295 (1970)
A theoretical study of the pyrolysis of isopropyl acetate.
Silva AM.
Chemical Physics Letters, 439(1), 8-13 (2007)
Vapor-liquid equilibria of carbon dioxide with isopropyl acetate, diethyl carbonate and ethyl butyrate at elevated pressures.
Cheng CH and Chen YP.
Fluid Phase Equilibria, 234(1), 77-83 (2005)
Madan Lal Verma et al.
Enzyme research, 2011, 919386-919386 (2011-05-24)
Selective production of fragrance fatty acid ester from isopropanol and acetic acid has been achieved using silica-immobilized lipase of Bacillus cereus MTCC 8372. A purified thermoalkalophilic extracellular lipase was immobilized by adsorption onto the silica. The effects of various parameters
Improved Fischer indole reaction for the preparation of N,N-dimethyltryptamines: Synthesis of L-695,894, a potent 5-HT1D receptor agonist.
Chen CY, et al.
The Journal of Organic Chemistry, 59(13), 3738-3741 (1994)

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