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Merck
CN

M29908

Sigma-Aldrich

苯甲酸甲酯

99%

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别名:
Methyl benzenecarboxylate
线性分子式:
C6H5COOCH3
CAS号:
分子量:
136.15
Beilstein:
1072099
EC 号:
MDL编号:
UNSPSC代码:
12352100
PubChem化学物质编号:
NACRES:
NA.22

蒸汽密度

4.68 (vs air)

质量水平

蒸汽压

<1 mmHg ( 20 °C)

检测方案

99%

形式

liquid

折射率

n20/D 1.516 (lit.)

bp

198-199 °C (lit.)

mp

−12 °C (lit.)

溶解性

H2O: soluble 2.1 g/L at 20 °C

密度

1.088 g/mL at 20 °C (lit.)

SMILES字符串

COC(=O)c1ccccc1

InChI

1S/C8H8O2/c1-10-8(9)7-5-3-2-4-6-7/h2-6H,1H3

InChI key

QPJVMBTYPHYUOC-UHFFFAOYSA-N

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一般描述

苯甲酸甲酯是一种挥发性芳香族酯化合物,广泛用于香料工业。这种成分在番石榴、芒果和奇异果中天然存在。

应用

苯甲酸甲酯(C6H5CO2CH3)可用作以下反应的前体:
  • 使用载体锰氧化物催化剂选择性合成苯甲醛。;
  • 通过傅-克酰基化与芳基化合物反应制备二苯甲酮衍生物。

象形图

Health hazardExclamation mark

警示用语:

Warning

危险声明

危险分类

Acute Tox. 4 Oral - Repr. 2

WGK

WGK 1

闪点(°F)

Pensky-Martens closed cup

闪点(°C)

Pensky-Martens closed cup

个人防护装备

Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter

法规信息

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Characterization and Activity of MnO/γ-Al2O3 for Hydrogenation of Methyl Benzoate to Benzaldehyde
Xu H-L, et al.
Chin. J. Chem., 19(7), 647-651 (2001)
Direct aerobic oxidation of primary alcohols to methyl esters catalyzed by a heterogeneous gold catalyst
Nielsen IS, et al.
Catalysis Letters, 116(1-2), 35-40 (2007)
Hydrogenation of methyl benzoate to benzaldehyde over manganese oxide catalysts prepared from Mg/Mn/Al hydrotalcite-like compounds
Chen A, et al.
Applied Catalysis A: General, 274(1-2), 101-109 (2004)
N Dudareva et al.
The Plant cell, 12(6), 949-961 (2000-06-15)
In snapdragon flowers, the volatile ester methyl benzoate is the most abundant scent compound. It is synthesized by and emitted from only the upper and lower lobes of petals, where pollinators (bumblebees) come in contact with the flower. Emission of
Nan Zhao et al.
Plant physiology and biochemistry : PPB, 48(4), 279-287 (2010-03-05)
Two benzenoid esters, methyl salicylate (MeSA) and methyl benzoate (MeBA), were detected from insect-damaged rice plants. By correlating metabolite production with gene expression analysis, five candidate genes encoding putative carboxyl methyltransferases were identified. Enzymatic assays with Escherichia coli-expressed recombinant proteins

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