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108057

Sigma-Aldrich

苯乙酸甲酯

ReagentPlus®, ≥99%

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About This Item

线性分子式:
C6H5CH2CO2CH3
CAS号:
101-41-7
分子量:
150.17
Beilstein:
878795
EC 号:
202-940-9
MDL编号:
MFCD00008453
UNSPSC代码:
12352100
PubChem化学物质编号:
24846797
NACRES:
NA.22

质量水平

100

产品线

ReagentPlus®

方案

≥99%

折射率

n20/D 1.503 (lit.)

沸点

218 °C (lit.)

密度

1.066 g/mL at 20 °C (lit.)

SMILES字符串

COC(=O)Cc1ccccc1

InChI

1S/C9H10O2/c1-11-9(10)7-8-5-3-2-4-6-8/h2-6H,7H2,1H3

InChI key

CRZQGDNQQAALAY-UHFFFAOYSA-N

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相关类别

应用

苯乙酸甲酯用作分配系数测量实验的模型化合物。

生化/生理作用

苯乙酸甲酯在甲醇中光解后会分解。苯基乙酸甲酯用作酰化剂，且会引起 β-内酰胺中间体的对映选择性酰化（使用青霉素 G 酰胺酶）。苯乙酸甲酯是合成香料生产中的原料。

法律信息

ReagentPlus is a registered trademark of Merck KGaA, Darmstadt, Germany

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储存分类代码

10 - Combustible liquids

WGK

WGK 1

闪点(°F)

211.1 °F - closed cup

闪点(°C)

99.5 °C - closed cup

个人防护装备

Eyeshields, Gloves, multi-purpose combination respirator cartridge (US)

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分析证书(COA)

Lot/Batch Number
SDBB1271
STBK5646
STBK2745
STBK2746
STBH0837

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Yichen Cao et al.
Journal of pharmaceutical sciences, 93(11), 2768-2779 (2004-09-25)
The ability to predict drug solubility and partitioning in triglyceride solvents from the chemical structures of the solute and the triglyceride would be highly useful in drug formulation development and in screening drug candidates for lipid solubility and possibly drug
Photolysis of phenylacetic acid and methyl phenylacetate in methanol.
Meiggs TO and Miller SI.
Journal of the American Chemical Society, 94(6), 1989-1996 (1972)
Enantioselective acylation of a beta-lactam intermediate in the synthesis of loracarbef using penicillin G amidase.
Zmijewski Jr MJ, et al.
Tetrahedron Letters, 32(13), 1621-1622 (1991)
Jonathan Slaughter et al.
Chemistry (Weinheim an der Bergstrasse, Germany), 23(1), 167-175 (2016-10-30)
In investigating and seeking to mimic the reactivity of trimethylaluminium (TMA) with synthetic, ester-based lubricating oils, the reaction of methyl propionate 1 was explored with 1, 2 and 3 equivalents of the organoaluminium reagent. Spectroscopic analysis points to the formation of
Miriam Frida Karlsson et al.
Journal of agricultural and food chemistry, 57(13), 5903-5909 (2009-06-06)
The Guatemalan moth Tecia solanivora is an invasive pest of potato in Central and South America. The larvae infest potato tubers in the field as well as in storage facilities. The headspace of potato foliage and potato tubers was studied
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