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3-Chloropropiophenone, 96%

Catalog No. aaa1229022
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Catalog No. Quantity
AAA1229022 100 g
AAA1229009 10 g
AAA1229018 50 g
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Catalog No. AAA1229022

Supplier: Thermo Scientific Chemicals A1229022

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CAS: 936-59-4 | C9H9ClO | 168.62 g/mol

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. It is a precursor of phenyl vinyl ketone.

This Thermo Scientific Chemicals brand product was originally part of the Alfa Aesar product portfolio. Some documentation and label information may refer to the legacy brand. The original Alfa Aesar product / item code or SKU reference has not changed as a part of the brand transition to Thermo Scientific Chemicals.

Applications
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. It is a precursor of phenyl vinyl ketone.

Solubility
Insoluble in water.

Notes
Store in cool place. Keep container tightly closed in a dry and well-ventilated place. Keep away from strong oxidizing agents.

Chemical Identifiers

CAS 936-59-4
Molecular Formula C9H9ClO
Molecular Weight (g/mol) 168.62
MDL Number MFCD00000990
InChI Key KTJRGPZVSKWRTJ-UHFFFAOYSA-N
Synonym 3-chloropropiophenone, 1-propanone, 3-chloro-1-phenyl, beta-chloropropiophenone, 2-chloroethyl phenyl ketone, 3-chloropropanophenone, 3-chloro-1-phenyl-1-propanone, propiophenone, 3-chloro, 3-chloro-1-phenyl-propan-1-one, .beta.-chloropropiophenone, .omega.-chloropropiophenone
PubChem CID 70295
IUPAC Name 3-chloro-1-phenylpropan-1-one
SMILES C1=CC=C(C=C1)C(=O)CCCl

Specifications

Melting Point 46°C to 50°C
Boiling Point 113°C to 115°C (4 mmHg)
Flash Point >110°C (230°F)
Quantity 100 g
Beilstein 2043580
Solubility Information Insoluble in water.
Formula Weight 168.62
Percent Purity 96%
Chemical Name or Material 3-Chloropropiophenone
Hazard Category H315-H319-H335
Precautionary Statement P261-P264b-P271-P280-P302+P352-P304+P340-P305+P351+P338-P312-P332+P313-P362-P501c
EINECSNumber 213-317-6
TSCA Yes
Recommended Storage Ambient temperatures

RUO – Research Use Only