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227269

Sigma-Aldrich

异氰酸苄酯

99%

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别名:
α-Isocyanatotoluene, (Isocyanatomethyl)benzene, 1-(Isocyanatomethyl)benzene, Phenylmethyl isocyanate
线性分子式:
C6H5CH2NCO
CAS号:
3173-56-6
分子量:
133.15
Beilstein:
636508
EC 号:
221-640-9
MDL编号:
MFCD00009701
PubChem化学物质编号:
24853269
NACRES:
NA.22

质量水平

100

检测方案

99%

形式

liquid

折射率

n20/D 1.526 (lit.)

bp

101-104 °C/33 mmHg (lit.)

密度

1.078 g/mL at 25 °C (lit.)

SMILES字符串

O=C=NCc1ccccc1

InChI

1S/C8H7NO/c10-7-9-6-8-4-2-1-3-5-8/h1-5H,6H2

InChI key

YDNLNVZZTACNJX-UHFFFAOYSA-N

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相关类别

一般描述

异氰酸苄酯可抑制苯并[a] BP (BP)-DNA加合物的形成，并具有化学预防作用。

应用

用异氰酸苄酯研究了连续流玻璃微流控芯片中异氰酸酯衍生化反应的动力学。它也被用于利用Al-Salph络合物（674699）的多组分立体定向合成1,3-恶嗪烷-2,4-二酮。

象形图

Flame
GHS02

警示用语：

Warning

危险声明

H226

危险分类

Flam. Liq. 3

储存分类代码

3 - Flammable liquids

WGK

WGK 3

闪点(°F)

113.0 °F - closed cup

闪点(°C)

45 °C - closed cup

个人防护装备

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

法规信息

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Monica Brivio et al.
Analytical chemistry, 77(21), 6852-6856 (2005-11-01)
The reaction of propyl isocyanate (2), benzyl isocyanate (3), and toluene-2,4-diisocyanate (4) with 4-nitro-7-piperazino-2,1,3-benzoxadiazole (1) to yield the corresponding urea derivatives 5 was carried out in a continuous flow glass microfluidics chip. Real-time monitoring of the derivatization reactions was done
Tamara L Church et al.
Journal of the American Chemical Society, 129(26), 8156-8162 (2007-06-15)
The use of mechanistic information to develop a new, catalytic multicomponent reaction is described. The complex [(salph)Al(THF)2]+[Co(CO)4]- (1, salph = N,N'-o-phenylenebis(3,5-di-tert-butylsalicylideneimine), THF = tetrahydrofuran), which is known to carbonylate epoxides, aziridines, and beta-lactones, was used to catalyze the synthesis of
W A Smith et al.
Mutation research, 425(1), 143-152 (1999-03-20)
The large (>2000) and expanding number of natural and synthetic agents with potential cancer chemopreventive properties renders it economically and physically impossible to test each of these agents for their efficacy in the widely accepted 2-year animal bioassay and clinical
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Postharvest processing of maca (Lepidium meyenii Walp., Brassicaceae), a traditional high-altitude Andean root crop, involves slow field drying prior to milling into flour. The progressive tissue dehydration and release of hydrolytic enzymes and substrates from cellular compartments results in the
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A benzylureido-β-cyclodextrin was synthesized by the reaction of 6-amino-β-cyclodextrin with an active benzyl isocyanate. Then, it was bonded to silica gel by a thiol-ene addition reaction, obtaining a new benzylureido-β-cyclodextrin-based chiral stationary phase (BzCDP). Its chemical structure was characterized by
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