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Merck
CN

T71803

Sigma-Aldrich

特戊酸

99%

别名:

2,2-二甲基丙酸, 三甲基乙酸

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About This Item

线性分子式:
(CH3)3CCO2H
CAS号:
分子量:
102.13
Beilstein:
969480
EC 号:
MDL编号:
UNSPSC代码:
12352100
PubChem化学物质编号:
NACRES:
NA.22

蒸汽密度

3.6 (vs air)

质量水平

蒸汽压

9.75 mmHg ( 60 °C)

方案

99%

反应适用性

reaction type: C-H Activation

沸点

163-164 °C (lit.)

mp

32-35 °C (lit.)

密度

0.889 g/mL at 25 °C (lit.)

官能团

carboxylic acid

SMILES字符串

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

InChI

1S/C5H10O2/c1-5(2,3)4(6)7/h1-3H3,(H,6,7)

InChI key

IUGYQRQAERSCNH-UHFFFAOYSA-N

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一般描述

戊二酸是一种羧酸,用作配体以合成六核铈(IV)团簇。

应用

特戊酸可用于:
  • 用作钯的助催化剂,芳化未活化芳烃N-杂环化合物。
  • 用作羰基化suzuki反应的添加剂,以纳米钯为催化剂从芳基碘和芳基硼酸合成二芳甲酮。
  • 在8-氨基喹啉配体和钴催化剂作用下,参与苯甲酰胺与炔烃的环化反应,合成异喹诺酮类。

注意

刺激性臭味/恶臭

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价格

象形图

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Warning

危险声明

危险分类

Acute Tox. 4 Oral - Eye Irrit. 2 - Skin Irrit. 2

储存分类代码

11 - Combustible Solids

WGK

WGK 1

闪点(°F)

147.2 °F - closed cup

闪点(°C)

64 °C - closed cup

个人防护装备

Eyeshields, Faceshields, Gloves, type P3 (EN 143) respirator cartridges


历史批次信息供参考:

分析证书(COA)

Lot/Batch Number

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Guotao Li et al.
Journal of the American Chemical Society, 130(12), 3740-3741 (2008-03-04)
Propargylic pivalates with electronically unbiased internal alkynes are selectively transformed into (1Z,3E)-2-pivaloxy-1,3-dienes containing various functionalities. The unusual selectivity of 1,2-acyloxy migration over the structurally preferred 3,3-rearrangement is realized. This reaction is highly stereoselective and offers rapid access to dienes for
Tobias Illg et al.
ChemSusChem, 4(3), 392-398 (2011-02-09)
The two-step synthesis of tert-butyl peroxypivalate is performed in a single-channel microreactor. The first step, the deprotonation of tert-butyl hydroperoxide, is done in a simple mixer tube setup. The residence time section for the second reaction step is equipped with
Toshiaki Shimasaki et al.
Angewandte Chemie (International ed. in English), 49(16), 2929-2932 (2010-03-17)
Catalytic amination: The title reaction demonstrates the use of aryl carboxylates as suitable electrophilic coupling substrates in catalytic amination reactions. N-heterocyclic carbene ligands and NaOtBu promote the amination of aryl pivalates through the cleavage of normally unreactive aryl carbon-oxygen bonds
Phosphine-free, palladium-catalyzed arylation of heterocycles through C-H bond activation with pivalic acid as a cocatalyst.
Dongbing Zhao et al.
Chemistry (Weinheim an der Bergstrasse, Germany), 15(6), 1337-1340 (2008-12-31)
Qi Zhou et al.
Journal of the American Chemical Society, 135(9), 3307-3310 (2013-02-22)
We have developed a stereospecific nickel-catalyzed cross-coupling of benzylic pivalates with arylboroxines. The success of this reaction relies on the use of Ni(cod)2 as the catalyst and NaOMe as a uniquely effective base. This reaction has broad scope with respect

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