537470
Isobutyl acetate
99%
Sinónimos:
Acetic acid isobutyl ester
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About This Item
Fórmula lineal:
CH3COOCH2CH(CH3)2
Número de CAS:
Peso molecular:
116.16
Beilstein:
1741909
Número CE:
Número MDL:
Código UNSPSC:
12352108
ID de la sustancia en PubChem:
NACRES:
NA.21
Ensayo:
99%
bp:
115-117 °C (lit.)
presión de vapor:
15 mmHg ( 20 °C)
Productos recomendados
densidad de vapor
>4 (vs air)
Nivel de calidad
presión de vapor
15 mmHg ( 20 °C)
Ensayo
99%
Formulario
liquid
temp. de autoignición
793 °F
lim. expl.
10.5 %
impurezas
≤0.050% (water)
índice de refracción
n20/D 1.39 (lit.)
pH
6.7 (20 °C, 5 g/L)
bp
115-117 °C (lit.)
mp
−99 °C (lit.)
solubilidad
water: soluble 5.6 g/L at 20 °C
densidad
0.867 g/mL at 25 °C (lit.)
cadena SMILES
CC(C)COC(C)=O
InChI
1S/C6H12O2/c1-5(2)4-8-6(3)7/h5H,4H2,1-3H3
Clave InChI
GJRQTCIYDGXPES-UHFFFAOYSA-N
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Descripción general
Isobutyl acetate (IBA), one of the isomers of butyl acetate, is an odorant found in fruits. Vapor-liquid equilibria of its binary mixture with isobutyl alcohol at 20 and 101.3kPa have been evaluated. Its synthesis via lipase-catalyzed esterification reaction has been reported.
Aplicación
- Green Synthesis of the Flavor Esters with a Marine Candida parapsilosis Esterase Expressed in Saccharomyces cerevisiae.: This study demonstrates a green synthesis approach using a marine esterase for the production of flavor esters, including isobutyl acetate. The process employs Saccharomyces cerevisiae, showcasing the potential for sustainable production of flavoring agents in the food and beverage industry (Xue et al., 2020).
- In-line reaction monitoring of entacapone synthesis by Raman spectroscopy and multivariate analysis.: This research employs Raman spectroscopy to monitor the synthesis of entacapone in real-time. Isobutyl acetate is utilized as a solvent in the reaction, highlighting its relevance in pharmaceutical synthesis and process monitoring (Novak et al., 2011).
- Paint thinner exposure inhibits testosterone synthesis and secretion in a reversible manner in the rat.: This study investigates the effects of paint thinner exposure, which contains isobutyl acetate, on testosterone synthesis in rats. The findings provide insights into the potential endocrine-disrupting properties of isobutyl acetate in industrial applications (Yilmaz et al., 2006).
- Preparation of spherically agglomerated crystals of aminophylline.: This research explores the preparation of aminophylline crystals using isobutyl acetate as a solvent. The study emphasizes the compound′s utility in pharmaceutical formulations to enhance drug solubility and bioavailability (Kawashima et al., 1984).
Palabra de señalización
Danger
Frases de peligro
Consejos de prudencia
Clasificaciones de peligro
Flam. Liq. 2 - STOT SE 3
Órganos de actuación
Central nervous system
Código de clase de almacenamiento
3 - Flammable liquids
Clase de riesgo para el agua (WGK)
WGK 1
Punto de inflamabilidad (°F)
71.6 °F - Pensky-Martens closed cup
Punto de inflamabilidad (°C)
22 °C - Pensky-Martens closed cup
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