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


45-335614-10G	10 g	$94.60 1/EA	Add To Favorites
45-335614-50G	50 g	$191.00 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

Properties
Descriptions
Safety Info.
Basic Data

assay	98%
bp	113-115 °C/4 mmHg (lit.)
form	solid
functional group	chloro
	ketone
	phenyl
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.)
Quality Level	200
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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