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Merck
CN

145300

Sigma-Aldrich

3,4-(亚甲二氧基)苯乙腈

99%

别名:

1,3-苯并二氧杂环戊烯-5-乙腈, 胡椒乙腈

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About This Item

经验公式(希尔记法):
C9H7NO2
CAS号:
分子量:
161.16
Beilstein:
7739
EC 号:
MDL编号:
UNSPSC代码:
12352100
PubChem化学物质编号:
NACRES:
NA.22

质量水平

方案

99%

mp

43-45 °C (lit.)

官能团

nitrile

SMILES字符串

N#CCc1ccc2OCOc2c1

InChI

1S/C9H7NO2/c10-4-3-7-1-2-8-9(5-7)12-6-11-8/h1-2,5H,3,6H2

InChI key

ZQPBOYASBNAXOZ-UHFFFAOYSA-N

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一般描述

3,4-(Methylenedioxy)phenylacetonitrile undergoes hydrolysis catalyzed by nitrilase ZmNIT2 enzyme from maize.

应用

3,4-(Methylenedioxy)phenylacetonitrile was used in synthesis of derrubone. It was used as standard to analyze the seized methamphetamine samples showing unique profiles of stable isotopic compositions by isotope ratio mass spectrometry.

象形图

Exclamation mark

警示用语:

Warning

危险声明

危险分类

Acute Tox. 4 Dermal - Acute Tox. 4 Inhalation - Acute Tox. 4 Oral

储存分类代码

11 - Combustible Solids

WGK

WGK 3

闪点(°F)

235.4 °F - closed cup

闪点(°C)

113 °C - closed cup

个人防护装备

dust mask type N95 (US), Eyeshields, Gloves

法规信息

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分析证书(COA)

Lot/Batch Number

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Seized methamphetamine samples with unique profiles of stable nitrogen isotopic composition documented by stable isotope ratio mass spectrometry.
Iwata YT, et al.
Forensic Toxicology, 28(2), 119-123 (2010)
Jedidiah M Hastings et al.
The Journal of organic chemistry, 73(2), 369-373 (2007-12-25)
Recently, we reported that the natural product derrubone exhibits Hsp90 inhibitory activity. Due to its unique architectural scaffold and proposed rapid assembly, the synthesis of this natural product was pursued with the aim of identifying structure--activity relationships. Synthesis of the
Enzymatic nitrile hydrolysis catalyzed by nitrilase ZmNIT2 from maize. An unprecedented ?-hydroxy functionality enhanced amide formation.
Mukherjee C, et al.
Tetrahedron, 62(26), 6150-6154 (2006)

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