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645-45-4,MFCD00000748
Catalog No.:AA003JT1

645-45-4 | 3-Phenylpropionyl chloride, tech grade

Pack Size
Purity
Availability
Price(USD)
Quantity
  
10g
96%
in stock  
$8.00   $6.00
- +
25g
96%
in stock  
$18.00   $13.00
- +
100g
96%
in stock  
$71.00   $50.00
- +
  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA003JT1
Chemical Name:
3-Phenylpropionyl chloride, tech grade
CAS Number:
645-45-4
Molecular Formula:
C9H9ClO
Molecular Weight:
168.6202
MDL Number:
MFCD00000748
SMILES:
ClC(=O)CCc1ccccc1
NSC Number:
2854
Properties
Properties
 
BP:
107 °C11 mm Hg(lit.)  
Form:
Liquid  
MP:
−7-−5 °C(lit.)  
Refractive Index:
n20/D 1.5265(lit.)  
Stability:
Moisture Sensitive  
Storage:
Inert atmosphere;2-8℃;  

Computed Properties
 
Complexity:
128  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
1  
Rotatable Bond Count:
3  
XLogP3:
2.8  

Upstream Synthesis Route

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Downstream Synthesis Route

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645-45-4    59-46-1   
4-(3-phenyl-propionylamino)-benzoicacid-(2-diethylamino-ethylester) 

[1]Patent:FR48815,1937,

[1]ChemicalScience,2018,vol.9,p.380-386

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Literature

Title: (3aS,7aS)-5-[(S)-3,3,3-Trifluoro-2-meth-oxy-2-phenyl-propano-yl]-2,3,4,5,6,7-hexa-hydro-1H-pyrrolo[3,4-c]pyridin-3(2H)-one monohydrate.

Journal: Acta crystallographica. Section E, Structure reports online 20100101

Title: Asymmetric synthesis, structure, and reactivity of unexpectedly stable spiroepoxy-beta-lactones including facile conversion to tetronic acids: application to (+)-maculalactone A.

Journal: The Journal of organic chemistry 20090703

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