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4672-30-4,MFCD00485102
Catalog No.:AA003HSP

4672-30-4 | (2-Phenylethyl)phosphonic acid

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Purity
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200mg
>98.0%(HPLC)
in stock  
$397.00   $278.00
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1g
>98.0%(HPLC)
in stock  
$1,236.00   $865.00
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA003HSP
Chemical Name:
(2-Phenylethyl)phosphonic acid
CAS Number:
4672-30-4
Molecular Formula:
C8H11O3P
Molecular Weight:
186.1449
MDL Number:
MFCD00485102
SMILES:
OP(=O)(CCc1ccccc1)O
NSC Number:
140288
Properties
Properties
 
Form:
Solid  
MP:
136.0 to 140.0℃  
Storage:
Room Temperature;  

Computed Properties
 
Complexity:
169  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Rotatable Bond Count:
3  
XLogP3:
0.4  

Downstream Synthesis Route

[1]Jensen;Noller[JournaloftheAmericanChemicalSociety,1949,vol.71,p.2384]

[1]Bergmann;Bondi[ChemischeBerichte,1933,vol.66,p.278,282]

[1]Bergmann;Bondi[ChemischeBerichte,1930,vol.63,p.1158,1166][ChemischeBerichte,1931,vol.64,p.1455,1480]

[1]Galardy;Grobelny[JournalofMedicinalChemistry,1985,vol.28,#10,p.1422-1427]

[1]Ohms,G.;Grossmann,G.;Schwab,B.;Schiefer,H.[Phosphorus,SulfurandSiliconandtheRelatedElements,1992,vol.68,#1-4,p.77-90]

Literature

Title: Inhibition of 1-deoxy-D-xylulose-5-phosphate reductoisomerase by lipophilic phosphonates: SAR, QSAR, and crystallographic studies.

Journal: Journal of medicinal chemistry 20110714

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