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Merck

689092

Sigma-Aldrich

乙酰醋酸异丙酯

Arxada quality, ≥99.0% (GC)

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About This Item

线性分子式:
CH3COCH2COOCH(CH3)2
CAS号:
分子量:
144.17
Beilstein:
1757046
EC號碼:
MDL號碼:
分類程式碼代碼:
12352100
PubChem物質ID:
NACRES:
NA.22

化驗

≥99.0% (GC)

形狀

liquid

品質

Arxada quality

製造商/商標名

Arxada AG

雜質

≤0.10% acid (as acetic acid)
≤0.10% water
≤0.5% ethyl acetoacetate

bp

95 °C/52 hPa (lit.)

密度

0.989 g/mL at 20 °C (lit.)

SMILES 字串

CC(C)OC(=O)CC(C)=O

InChI

1S/C7H12O3/c1-5(2)10-7(9)4-6(3)8/h5H,4H2,1-3H3

InChI 密鑰

GVIIRWAJDFKJMJ-UHFFFAOYSA-N

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應用

乙酰乙酸异丙酯可用作反应物,
  • 在Ti(O-i-Pr)4存在下通过Knoevenagel反应合成:2-乙酰基-3-苯基-2-丙烯酸异丙酯。
  • 通过与肉桂醛和伯胺反应取代1,4-二氢吡啶。
  • 5-异丙氧羰基-6-甲基-4-苯基-3,4-二氢嘧啶-2(1H)-硫酮,通过与苯甲醛和硫脲的Biginelli反应。

象形圖

Exclamation mark

訊號詞

Warning

危險聲明

危險分類

Skin Irrit. 2

儲存類別代碼

10 - Combustible liquids

水污染物質分類(WGK)

WGK 1

閃點(°F)

159.8 °F - closed cup

閃點(°C)

71 °C - closed cup

個人防護裝備

Eyeshields, Gloves, type ABEK (EN14387) respirator filter


分析证书(COA)

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Organocatalytic asymmetric three-component cyclization of cinnamaldehydes and primary amines with 1, 3-dicarbonyl compounds: straightforward access to enantiomerically enriched dihydropyridines
Jiang J, et al.
Angewandte Chemie (International Edition in English), 47(13), 2458-2462 (2008)
Novel Knoevenagel-type reaction via titanium enolate derived from Ti(Oi-Pr)4 and diketene
Hayashi M, et al.
Tetrahedron, 60(32), 6777-6783 (2004)
Synthesis and biological evaluation of novel isopropyl 2-thiazolopyrimidine-6-carboxylate derivatives
Kotaiah Y, et al.
J. Korean Chem. Soc., 56(1), 68-73 (2012)
M M V Ramana et al.
Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy, 152, 165-171 (2015-07-25)
In the present work, isopropyl-6-amino-4-(3,5-bis(trifluoromethyl)phenyl)-5-cyano-2-methyl-4H-pyran-3-carboxylate (4H-pyran analog) has been synthesized by a three component reaction catalyzed by CsOH/γ-Al2O3 and characterized. The interaction of 4H-pyran analog with herring sperm DNA (hs DNA) under physiological conditions (phosphate buffer of pH 7.2) was

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