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Merck
CN

442446

3-Chloro-1-propene

analytical standard

Synonym(s):

Allyl chloride, 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
EC Number:
203-457-6
UNSPSC Code:
12352200
PubChem Substance ID:
24867856
Beilstein/REAXYS Number:
635704
MDL number:
MFCD00000984

Key Documents

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InChI

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

InChI key

OSDWBNJEKMUWAV-UHFFFAOYSA-N

SMILES string

ClCC=C

grade

analytical standard

vapor density

2.6 (vs air)

vapor pressure

20.58 psi ( 55 °C), 5.71 psi ( 20 °C)

expl. lim.

11.2 %

packaging

ampule of 1000 mg

technique(s)

HPLC: suitable, gas chromatography (GC): suitable

refractive index

n20/D 1.414 (lit.)

bp

44-46 °C (lit.)

mp

−130 °C (lit.)

density

0.939 g/mL at 25 °C (lit.)

application(s)

cleaning products
cosmetics
environmental
food and beverages
personal care

format

neat

storage temp.

room temp

General description

3-Chloro-1-propene can undergo reaction with copper(I)bromide-augmented organozinc reagent in the presence of cuprous bromide to yield phosphonate.

Application

Refer to the product′s Certificate of Analysis for more information on a suitable instrument technique. Contact Technical Service for further support.

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
LC19979V
LC03617V
LC03141V
LB83214V
LB78234

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Allylations of [(diethoxyphosphinyl) difluoromethyl] zinc bromide as a convenient route to 1, 1-difluoro-3-alkenephosphonates
Burton.JD and Sprague.GL
The Journal of Organic Chemistry, 54, 613-617 (1989)
Histopathological changes within the testis caused by allyl chloride exposure in mice.
M Zhao et al.
Bulletin of environmental contamination and toxicology, 60(3), 494-501 (1998-04-07)
Shin-ichi Ikeda et al.
Chemical communications (Cambridge, England), (4)(4), 457-459 (2006-02-24)
The Ni-catalyzed coupling of allyl chlorides and enynes has been developed; the cyclization of enynes was triggered by the addition of pi-allylnickel species to the alkyne part, followed by the incorporation of the alkene part.
B M de Rooij et al.
Drug metabolism and disposition: the biological fate of chemicals, 24(7), 765-772 (1996-07-01)
Allyl chloride (AC) is used as intermediate in the synthesis of epichlorohydrin (ECH). We investigated the biotransformation of AC in rats to select potential urinary biomarkers of exposure. For this purpose, we developed analytical methods to measure different selected urinary
Yan-Bo Yu et al.
Chemistry (Weinheim an der Bergstrasse, Germany), 18(46), 14643-14648 (2012-10-12)
Simply id(all)ylic: a copper- and phosphine-ligand-free Pd-catalyzed direct allylation of electron-deficient polyfluoroarenes with allylic chlorides and the reaction mechanism are described. The simple catalytic system, broad substrate scope, and excellent functional-group compatibility of this protocol provides a useful and facile
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