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安全信息

T53805

Sigma-Aldrich

三氯乙腈

98%

别名:

Trichlorocyanomethane, Tritox

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About This Item

线性分子式:
Cl3CCN
CAS号:
545-06-2
分子量:
144.39
Beilstein:
605572
EC 号:
208-885-7
MDL编号:
MFCD00001842
UNSPSC代码:
12352117
PubChem化学物质编号:
24900271
NACRES:
NA.22

蒸汽压

58 mmHg ( 20 °C)

质量水平

200

方案

98%

折射率

n20/D 1.441 (lit.)

沸点

83-84 °C (lit.)

密度

1.44 g/mL at 25 °C (lit.)

SMILES字符串

ClC(Cl)(Cl)C#N

InChI

1S/C2Cl3N/c3-2(4,5)1-6

InChI key

DRUIESSIVFYOMK-UHFFFAOYSA-N

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相关类别

应用

用于通过 DBU 催化的烯丙醇加成反应合成三氯乙酰亚胺酯，以及用于 MOM 催化型氮杂-Claisen 重排反应的后续研究。还可用于由二醇制备双三氯乙酰亚胺酯，再通过酸催化的环化反应生成二氢噁嗪。

象形图

Skull and crossbonesEnvironment
GHS06,GHS09

警示用语：

Danger

危险分类

Acute Tox. 3 Dermal - Acute Tox. 3 Inhalation - Acute Tox. 3 Oral - Aquatic Chronic 2

储存分类代码

6.1C - Combustible acute toxic Cat.3 / toxic compounds or compounds which causing chronic effects

WGK

WGK 3

闪点(°F)

165.2 °F

闪点(°C)

74 °C

个人防护装备

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

法规信息

危险化学品

历史批次信息供参考:

分析证书(COA)

Lot/Batch Number
BCCL6364
BCCK7316
BCCJ6637
BCCF1453
BCCB5307

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Christophe Rondot et al.
Organic letters, 9(2), 247-250 (2007-01-16)
An efficient synthesis of chiral dihydrooxazines (2) from 1-aryl-2-amino-propane-1,3-diols (1) via the corresponding bistrichloroacetimidate intermediates has been developed. In this transformation, one trichloroacetimidate acts as a leaving group and the other acts as a nucleophile. The cyclization proceeds through an
Tetrahedron, 63, 2123-2123 (2007)
E L Lin et al.
Cancer letters, 62(1), 1-9 (1992-02-14)
Male Fisher 344 rats were administered 1- or 2-[14C]trichloroacetonitrile (TCAN) by oral gavage. DNA was isolated from the liver, kidneys and stomach and several protein fractions (globin, albumin and globulins) were isolated from blood. TCAN binds to both the DNA
Trichloroacetonitrile.
IARC monographs on the evaluation of carcinogenic risks to humans, 71 Pt 3, 1533-1537 (1999-09-07)
M K Smith et al.
Teratology, 38(2), 113-120 (1988-08-01)
Trichloroacetonitrile (TCAN) is among a number of contaminants found in drinking water produced by reactions of chlorine with background organic material. Long-Evans rats were intubated with TCAN (0, 1, 7.5, 15, 35, 55 mg/kg) in a tricaprylin vehicle on gestation
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