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3-Chloropropiophenone

ALDRICH/335614 - 98%

Synonym: β-Chloropropiophenone; 3-Chloro-1-phenyl-1-propanone

CAS Number: 936-59-4
Empirical Formula (Hill Notation): C9H9ClO
Molecular Weight: 168.62
EC Number: 213-317-6
MDL Number: MFCD00000990
Linear Formula: ClCH2CH2COC6H5
Product Type: Chemical
Catalog Number PKG Qty. Price Quantity
45-335614-10G 10 g
 $88.90
1/EA		 Add To Favorites
45-335614-50G 50 g
 $179.00
1/EA		 Add To Favorites
This picture is provided solely for illustration purposes. Optical properties of the actual product may deviate. Relevant product information is printed on labeled products and other accompanying or available information material. This image depicts SKU: 335614-50G

 

assay 98%
bp 113-115 °C/4 mmHg (lit.)
form solid
InChI 1S/C9H9ClO/c10-7-6-9(11)8-4-2-1-3-5-8/h1-5H,6-7H2
InChI key KTJRGPZVSKWRTJ-UHFFFAOYSA-N
mp 48-50 °C (lit.)
SMILES string ClCCC(=O)c1ccccc1
Application: 3-Chloropropiophenone was used in the asymmetric reduction of (S)-3-chloro-1-phenylpropanol using preheated Candida utilis cells immobilized in calcium alginate gel beads. It was also used in the synthesis of (R)-3-chloro-1-phenyl-1-propanol via asymmetric reduction using in-situ generated oxazaborolidine catalyst derived from (S)-α,α-diphenylprolinol.
Packaging: 10, 50 g in glass bottle
RIDADR NONH for all modes of transport
WGK Germany WGK 3
Flash Point(F) Not applicable
Flash Point(C) Not applicable
Purity 98%
bp 113-115 °C/4 mmHg (lit.)
mp 48-50 °C (lit.)
UNSPSC 12352100

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