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Merck
CN

143995

Propargyl chloride

98%

Synonym(s):

3-Chloro-1-propyne

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About This Item

Linear Formula:
HC≡CCH2Cl
CAS Number:
624-65-7
Molecular Weight:
74.51
UNSPSC Code:
12352100
NACRES:
NA.22
PubChem Substance ID:
24848620
EC Number:
210-856-9
Beilstein/REAXYS Number:
506005
MDL number:
MFCD00000980

Key Documents

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Product Name

Propargyl chloride, 98%

SMILES string

ClCC#C

InChI key

LJZPPWWHKPGCHS-UHFFFAOYSA-N

InChI

1S/C3H3Cl/c1-2-3-4/h1H,3H2

assay

98%

form

liquid

refractive index

n20/D 1.435 (lit.)

bp

58 °C (lit.)

solubility

benzene: miscible
chloroform: miscible
diethyl ether: miscible
ethanol: miscible
ethyl acetate: miscible
ethylene glycol: miscible
water: insoluble

density

1.03 g/mL at 25 °C (lit.)

functional group

alkyl halide
chloro

storage temp.

2-8°C

Quality Level

100

Related Categories

Application

Propargyl chloride was used to study emission spectra of dissociating propargyl chloride upon photoexcitation at 199 nm. It was used in the synthesis of novel tetraaryl analog of bisphenol A and triaryl analog of bisphenol A propargyl resins.

General description

Propargyl chloride is an efficient propargylating agent. It generates propargyl radicals by the pulsed laser photolysis.

signalword

Danger

Hazard Classifications

Acute Tox. 3 Oral - Flam. Liq. 2 - Skin Corr. 1B

Storage Class

3 - Flammable liquids

wgk

WGK 2

flash_point_f

66.2 °F - closed cup

flash_point_c

19 °C - closed cup

ppe

Faceshields, Gloves, Goggles

Regulatory Information

危险化学品
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Certificates of Analysis (COA)

Lot/Batch Number
MKDB0573
MKCZ6487
MKCX6557
MKCT3724
MKCQ6303

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Akira Matsugi et al.
The journal of physical chemistry. A, 115(26), 7610-7624 (2011-05-24)
The kinetics and mechanisms of the self-reaction of allyl radicals and the cross-reaction between allyl and propargyl radicals were studied both experimentally and theoretically. The experiments were carried out over the temperature range 295-800 K and the pressure range 20-200
Investigating the C-Cl Antibonding Character in the pp* Excited State of Vinyl, Allyl, and Propargyl Chloride: Emission Spectra and ab Initio Calculations.
Browning PW, et al.
The Journal of Physical Chemistry, 100(19), 7765-7771 (1996)
DIPROPARGYL ETHERS OF HIGH ASPECT RATIO BISPHENOLS.
Filipova TS, et al.
Polymer Preprints (American Chemical Society, Division of Polymer Chemistry), 48(1), 388-388 (2007)
Lyudmila A Grischenko et al.
Carbohydrate research, 376, 7-14 (2013-06-04)
New arabinogalactan propargyl ethers with degree of substitution (DS) up to 2.8 have been obtained by propargylation of arabino-3,6-galactan (AG) with propargyl bromide (PB) in the two-phase system 30-60% КОН aqueous solution/toluene in the presence of triethylbenzylammonium chloride (TEBAС) or

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