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3-Phenylpropionyl chloride, 98%, Thermo Scientific Chemicals
$91.21 - $1281.78
Chemical Identifiers
CAS | 645-45-4 |
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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 |
Catalog Number | Mfr. No. | Quantity | Price | Quantity | |||||
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Catalog Number | Mfr. No. | Quantity | Price | Quantity | |||||
AAA1086009
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Thermo Scientific Chemicals
A1086009 |
10 g |
Each for $91.21
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AAA1086030
|
Thermo Scientific Chemicals
A1086030 |
250 g |
Each for $1,281.78
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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.
ApplicationsThe 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.
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 | |
UN3265 | |
Moisture sensitive | |
Soluble in water (reacts),and ether. | |
C1=CC=C(C=C1)CCC(=O)Cl | |
168.62 | |
168.62 | |
3-Phenylpropionyl chloride |
-7°C | |
225°C | |
Acrid | |
1.5265 | |
10 g | |
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% |
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
DOTInformation : Transport Hazard Class: 8; Packing Group: II; Proper Shipping Name: CORROSIVE LIQUID, ACIDIC, ORGANIC, N.O.S.
EINECSNumber : 211-443-6
RTECSNumber : MW5652395
TSCA : Yes
Recommended Storage : Ambient temperatures
RUO – Research Use Only