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248193

3′-Chloropropiophenone

Name: 3′-Chloropropiophenone
Brand: ALDRICH

98%

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About This Item

Linear Formula:

ClC₆H₄COC₂H₅

CAS Number:

34841-35-5

Molecular Weight:

168.62

NACRES:

NA.22

PubChem Substance ID:

24854919

UNSPSC Code:

12352100

EC Number:

252-242-3

MDL number:

MFCD00009925

Assay:

98%

Form:

solid

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Properties

Quality Segment

100

assay

98%

form

solid

bp

124 °C/14 mmHg (lit.)

mp

45-47 °C (lit.)

functional group

chloro, ketone

SMILES string

CCC(=O)c1cccc(Cl)c1

InChI

1S/C9H9ClO/c1-2-9(11)7-4-3-5-8(10)6-7/h3-6H,2H2,1H3

InChI key

PQWGFUFROKIJBO-UHFFFAOYSA-N

Description

General description

Influence of solvents and temperature on the yield and enantioselectivity of the phenylation of 3′-chloropropiophenone has been investigated.

Application

3′-Chloropropiophenone can be used as a reactant to synthesize:

(S)-3-chloro-1-phenylpropanol via bio-catalyzed asymmetric reduction method.
1-(3-Chlorophenyl)-1-phenyl-1-propanol by phenylation with diphenylzinc in the presence of dihydroxy bis(sulfonamide) ligand.
(S)-Dapoxetine, a selective serotonin reuptake inhibitor.

Storage Class

11 - Combustible Solids

wgk

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

Eyeshields, Gloves, type N95 (US)

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