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About This Item
Linear Formula:
ClC6H4CH=CHOCOC6H5
CAS Number:
Molecular Weight:
242.70
EC Number:
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22
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Quality Level
Assay
97%
form
solid
mp
113-117 °C (lit.)
functional group
chloro
ketone
phenyl
SMILES string
Clc1ccc(cc1)\C=C\C(=O)c2ccccc2
InChI
1S/C15H11ClO/c16-14-9-6-12(7-10-14)8-11-15(17)13-4-2-1-3-5-13/h1-11H/b11-8+
InChI key
ABGIIXRNMHUKII-DHZHZOJOSA-N
General description
4-Chlorochalcone is a chalcone derivative. Its crystals exhibit monoclinic system with space group P21/c. It can undergo conjugate addition reaction with pyrrole in the presence of AlKIT-5 (mesoporous 3D aluminosilicate catalyst) to form the corresponding C2-alkylated pyrrole derivatives.
Storage Class Code
11 - Combustible Solids
WGK
WGK 3
Flash Point(F)
Not applicable
Flash Point(C)
Not applicable
Personal Protective Equipment
dust mask type N95 (US), Eyeshields, Gloves
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Highly Efficient Friedel-Crafts Alkylation of Indoles and Pyrrole Catalyzed by Mesoporous 3D Aluminosilicate Catalyst with Electron-Deficient Olefins.
Naidu TS, et al.
Synlett, 18, 2813-2817 (2010)
Structure of 4-chlorochalcone.
Li Z and Su G.
Acta Crystallographica Section C, Crystal Structure Communications, 50(1), 126-127 (1994)
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