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Merck
CN

236306

Allyl chloride

ReagentPlus®, 99%

Synonym(s):

3-Chloro-1-propene, Chlorallylene

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About This Item

Linear Formula:
CH2=CHCH2Cl
CAS Number:
107-05-1
Molecular Weight:
76.52
UNSPSC Code:
12352100
NACRES:
NA.22
PubChem Substance ID:
24854161
EC Number:
203-457-6
Beilstein/REAXYS Number:
635704
MDL number:
MFCD00000984
Assay:
99%
Form:
liquid

Key Documents

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InChI key

OSDWBNJEKMUWAV-UHFFFAOYSA-N

InChI

1S/C3H5Cl/c1-2-3-4/h2H,1,3H2

SMILES string

ClCC=C

vapor density

2.6 (vs air)

vapor pressure

20.58 psi ( 55 °C), 5.71 psi ( 20 °C)

product line

ReagentPlus®

assay

99%

form

liquid

expl. lim.

11.2 %

refractive index

n20/D 1.414 (lit.)

bp

44-46 °C (lit.)

mp

−130 °C (lit.)

solubility

alcohol: miscible(lit.), chloroform: miscible(lit.), diethyl ether: miscible(lit.), petroleum ether: miscible(lit.), water: slightly soluble(lit.)

density

0.939 g/mL at 25 °C (lit.)

functional group

alkyl halide, chloro

storage temp.

2-8°C

Quality Level

100

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General description

Kinetcis of epoxidation of allyl chloride with hydrogen peroxide has been reported.

Application

Allyl chloride has been employed:
  • as precursor for generation of allyl radicals by laser flash photolysis at 193nm
  • in the synthesis of α,ω-difunctional chemical intermediates via the cross-metathesis reactions

Legal Information

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

signalword

Danger

Hazard Classifications

Acute Tox. 4 Dermal - Acute Tox. 4 Inhalation - Acute Tox. 4 Oral - Aquatic Acute 1 - Carc. 2 - Eye Irrit. 2 - Flam. Liq. 2 - Muta. 2 - Skin Irrit. 2 - STOT RE 2 - STOT SE 3

target_organs

Nervous system,Liver,Kidney, Respiratory system

Storage Class

3 - Flammable liquids

wgk

WGK 2

flash_point_f

-25.6 °F

flash_point_c

-32 °C

ppe

Eyeshields, Faceshields, Gloves

Regulatory Information

危险化学品
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Certificates of Analysis (COA)

Lot/Batch Number
SDBB7263
MKCT2334
MKCT2335
STBK3883
STBJ4696

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Lars Seidel et al.
Molecules (Basel, Switzerland), 18(11), 13608-13622 (2013-11-07)
Photochemically driven reactions involving unsaturated radicals produce a thick global layer of organic haze on Titan, Saturn's largest moon. The allyl radical self-reaction is an example for this type of chemistry and was examined at room temperature from an experimental
Epoxidation of allyl chloride with hydrogen peroxide catalyzed by titanium silicalite 1.
Gao H, et al.
Applied Catalysis A: General, 138(1), 27-38 (1996)
Cross-metathesis reactions of allyl chloride with fatty acid methyl esters: Efficient synthesis of a, ?-difunctional chemical intermediates from renewable raw materials.
Jacobs T, et al.
Applied Catalysis A: General, 353(1), 32-35 (2009)
Fumihiro Amemiya et al.
Organic & biomolecular chemistry, 9(11), 4256-4265 (2011-04-13)
Product selectivity control based on a liquid-liquid parallel laminar flow has been successfully demonstrated by using a microreactor. Our electrochemical microreactor system enables regioselective cross-coupling reaction of aldehyde with allylic chloride via chemoselective cathodic reduction of substrate by the combined
Qing-Shan Wang et al.
Toxicology, 231(1), 58-67 (2006-12-30)
Allyl chloride (AC) is widely used in industries as raw material and has been reported to produce occupational peripheral neuropathies in man chronically exposure to it. Although many studies have been done addressing to it, the mechanisms still remain unclear.
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