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线性分子式:
CH3CH2CH2COO(CH2)3CH3
化学文摘社编号:
分子量:
144.21
UNSPSC Code:
12352100
NACRES:
NA.22
PubChem Substance ID:
EC Number:
203-656-8
Beilstein/REAXYS Number:
1747101
MDL number:
产品名称
丁酸丁酯, 98%
InChI key
XUPYJHCZDLZNFP-UHFFFAOYSA-N
InChI
1S/C8H16O2/c1-3-5-7-10-8(9)6-4-2/h3-7H2,1-2H3
SMILES string
CCCCOC(=O)CCC
assay
98%
form
liquid
refractive index
n20/D 1.406 (lit.)
bp
164-165 °C (lit.)
density
0.869 g/mL at 25 °C (lit.)
functional group
ester
Quality Level
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Application
Butyl butyrate can be used as a reactant to synthesize:
- N
- -(Phenylmethyl)butanamide by reacting with benzylamine via ester-amide exchange reaction in the presence of supported graphene oxide catalyst.
- Cyclohexyl butyrate by acylation reaction with cyclohexanol using a ruthenium pincer PNN complex catalyst.
- Butyl ether by triiron dodecacarbonyl catalyzed hydrosilylation reaction.
General description
Butyl butyrate is an ester present in pineapple flavor and is very important for the food and beverages industries. Kinetcis of butyl butyrate synthesis by enzymatic esterification and trans-esterification in supercritical carbon dioxide with a lipase, Novozym 435 has been reported.
signalword
Warning
hcodes
Hazard Classifications
Aquatic Chronic 2 - Flam. Liq. 3
存储类别
3 - Flammable liquids
wgk
WGK 2
flash_point_f
124.9 °F - closed cup
flash_point_c
51.6 °C - closed cup
ppe
Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter
法规信息
危险化学品
此项目有
Andréa B Martins et al.
Biotechnology progress, 29(6), 1416-1421 (2013-08-16)
Butyl butyrate is an ester present in pineapple flavor, which is very important for the food and beverages industries. In this work, the optimization of the reaction of butyl butyrate synthesis catalyzed by the immobilized lipase Lipozyme TL-IM was performed.
Ruthenium Pincer-Catalyzed Acylation of Alcohols Using Esters with Liberation of Hydrogen under Neutral Conditions
Gnanaprakasam B, et al.
Advanced Synthesis & Catalysis, 352(18), 3169-3173 (2010)
Ruthenium Pincer-Catalyzed Acylation of Alcohols Using Esters with Liberation of Hydrogen under Neutral Conditions
Gnanaprakasam B, et al.
advanced synthesis and catalysis, 352(18), 3169-3173 (2010)
Kinetics of synthesis of butyl butyrate by esterification and transesterification in supercritical carbon dioxide.
Varma MN and Madras G.
Journal of Chemical Technology and Biotechnology, 83(8), 1135-1144 (2008)
Unprecedented Ester-Amide Exchange Reaction Using Highly Versatile Two-Dimensional Graphene Oxide Supported Base Metal Nanocatalyst
Sharma RK, et al.
Industrial & Engineering Chemistry Research, 57(10), 3617-3627 (2018)
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