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3-Phenylpropionyl chloride, 98%, Thermo Scientific Chemicals

48.94 € - 703.50 €

Chemical Identifiers

CAS 645-45-4
Molecular Formula C9H9ClO
Molecular Weight (g/mol) 168.62
MDL Number MFCD00000748
InChI Key MFEILWXBDBCWKF-UHFFFAOYSA-N
Synonym 3-phenylpropionyl chloride, hydrocinnamoyl chloride, benzenepropanoyl chloride, dihydrocinnamoyl chloride, hydrocinnamyl chloride, propionyl chloride, 3-phenyl, hydrocinnamoylchloride, beta-phenylpropionyl chloride, 3-phenylpropionic acid chloride, beta-phenylpropanoyl chloride
PubChem CID 64801
IUPAC Name 3-phenylpropanoyl chloride
SMILES C1=CC=C(C=C1)CCC(=O)Cl
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Products 3
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Product Code Brand Quantity Price Quantity & Availability  
11449842
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Thermo Scientific Alfa Aesar
A10860.09
10 g
48.94 €
10g
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11459842
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Thermo Scientific Alfa Aesar
A10860.18
50 g This item is currently unavailable or has been discontinued.
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N/A
11469842
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Thermo Scientific Alfa Aesar
A10860.30
250 g
703.50 €
250g
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Description

Description

The 3-phenylpropionate (dihydrocinnamoyl) ester has been used as a protecting group in nucleoside synthesis. Used in the synthesis of 1-Phenyl-3-methyl-4-acyl-5- pyrazolones. N-(3-phenyl-n-propyl)-1-phenyl-2-aminopropane were prepared by acylation of the appropriate amine with 3-phenylpropionyl chloride followed by reduction of the resulting amide with either LiA1H4. For the preparation of the phenylacetyl (PA) and 3-phenylpropionyl (PP) derivatives, the corresponding amino acids were coupled in the usual manner with phenylacetyl chloride or 3-phenylpropionyl chloride in the presence of either NaOH(PA-LD- and DL-Pgly. 3-Phenylpropionyl chloride (4) was treated with diazomethane to give diazoketone. Allyloxy resin 12 was acylated with 3-phenylpropionyl chloride and treated with 50% TFA for 1 h followed by treatment with Pd(PPh3)4/PPh3 in solution to furnish the desired hydrox- amic acid.

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
The 3-phenylpropionate (dihydrocinnamoyl) ester has been used as a protecting group in nucleoside synthesis. Used in the synthesis of 1-Phenyl-3-methyl-4-acyl-5- pyrazolones. N-(3-phenyl-n-propyl)-1-phenyl-2-aminopropane were prepared by acylation of the appropriate amine with 3-phenylpropionyl chloride followed by reduction of the resulting amide with either LiA1H4. For the preparation of the phenylacetyl (PA) and 3-phenylpropionyl (PP) derivatives, the corresponding amino acids were coupled in the usual manner with phenylacetyl chloride or 3-phenylpropionyl chloride in the presence of either NaOH(PA-LD- and DL-Pgly. 3-Phenylpropionyl chloride (4) was treated with diazomethane to give diazoketone. Allyloxy resin 12 was acylated with 3-phenylpropionyl chloride and treated with 50% TFA for 1 h followed by treatment with Pd(PPh3)4/PPh3 in solution to furnish the desired hydrox- amic acid.

Notes
Moisture Sensitive. Store in cool place. Keep container tightly closed in a dry and well-ventilated place. Store away from strong oxidizing agents, amines, alcohols, active metals, bases, water, moisture.
Specifications

Chemical Identifiers

645-45-4
168.62
MFEILWXBDBCWKF-UHFFFAOYSA-N
64801
C1=CC=C(C=C1)CCC(=O)Cl
C9H9ClO
MFCD00000748
3-phenylpropionyl chloride, hydrocinnamoyl chloride, benzenepropanoyl chloride, dihydrocinnamoyl chloride, hydrocinnamyl chloride, propionyl chloride, 3-phenyl, hydrocinnamoylchloride, beta-phenylpropionyl chloride, 3-phenylpropionic acid chloride, beta-phenylpropanoyl chloride
3-phenylpropanoyl chloride

Specifications

645-45-4
1.135
108°C (226°F)
C9H9ClO
MFCD00000748
742586
3-phenylpropionyl chloride, hydrocinnamoyl chloride, benzenepropanoyl chloride, dihydrocinnamoyl chloride, hydrocinnamyl chloride, propionyl chloride, 3-phenyl, hydrocinnamoylchloride, beta-phenylpropionyl chloride, 3-phenylpropionic acid chloride, beta-phenylpropanoyl chloride
MFEILWXBDBCWKF-UHFFFAOYSA-N
3-phenylpropanoyl chloride
64801
98%
-7°C
225°C
Acrid
1.5265
UN3265
Moisture sensitive
Soluble in water (reacts),and ether.
C1=CC=C(C=C1)CCC(=O)Cl
168.62
168.62
3-Phenylpropionyl chloride
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Safety and Handling

Safety and Handling

GHS H Statement
H314-H318-H332
Causes severe skin burns and eye damage.
Causes serious eye damage.
Harmful if inhaled.

P260-P264b-P271-P280-P301+P330+P331-P303+P361+P353-P304+P340-P305+P351+P338-P310-P363-P501c

H314-H331-H335

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missing translation for 'einecsNumber' : 211-443-6

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missing translation for 'tsca' : Yes

Recommended Storage : Ambient temperatures

SDS
Documents

Documents

Product Certifications

RUO – Research Use Only