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22525-95-7,MFCD08703298
Catalog No.:AA00I4DB

22525-95-7 | 2'-(Oxiranylmethoxy)-3-phenylpropiophenone

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Purity
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1g
98%(GC)
in stock  
$318.00   $223.00
- +
5g
98%(GC)
in stock  
$1,267.00   $887.00
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00I4DB
Chemical Name:
2'-(Oxiranylmethoxy)-3-phenylpropiophenone
CAS Number:
22525-95-7
Molecular Formula:
C18H18O3
Molecular Weight:
282.3337
MDL Number:
MFCD08703298
SMILES:
O=C(c1ccccc1OCC1CO1)CCc1ccccc1
Properties
Properties
 
BP:
452.8°C at 760 mmHg  
Form:
Solid  
MP:
56-58 °C  
Storage:
Keep in dry area;2-8℃;  

Computed Properties
 
Complexity:
335  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
3  
Rotatable Bond Count:
7  
Undefined Atom Stereocenter Count:
1  
XLogP3:
3.2  

Downstream Synthesis Route

[1]Lowes,DavidJ.;Guiguemde,W.Armand;Connelly,MicheleC.;Zhu,Fangyi;Sigal,MartinaS.;Clark,JulieA.;Lemoff,AndrewS.;Derisi,JosephL.;Wilson,EmilyB.;Guy,R.Kiplin[JournalofMedicinalChemistry,2011,vol.54,#21,p.7477-7485]

[2]Chiba,Peter;Burghofer,Sabine;Richter,Elisabeth;Tell,Barbara;Moser,Andrea;Ecker,Gerhard[JournalofMedicinalChemistry,1995,vol.38,#14,p.2789-2793]

[3]Zhan,Xiao-Yu;Zhang,Hua;Dong,Yu;Yang,Jian;He,Shuai;Shi,Zhi-Chuan;Tang,Lei;Wang,Ji-Yu[JournalofOrganicChemistry,2020,vol.85,#10,p.6578-6592]

[4]Hege;Weymann;Lietz[Arzneimittel-Forschung/DrugResearch,1984,vol.34,#8,p.843-849]

[5]Ecker;Chiba;Hitzler;Schmid;Visser;Cordes;Csollei;Seydel;Schaper[JournalofMedicinalChemistry,1996,vol.39,#24,p.4767-4774]

[6]Locationinpatent:schemeortableThai,Khac-Minh;Windisch,Andreas;Stork,Daniela;Weinzinger,Anna;Schiesaro,Andrea;Guy,RobertH.;Timin,EugenN.;Hering,Steffen;Ecker,GerhardF.[ChemMedChem,2010,vol.5,#3,p.436-442]

[1]JournalofMedicinalChemistry,2011,vol.54,p.7477-7485

[1]JournalofMedicinalChemistry,2011,vol.54,p.7477-7485

67455-41-8    22525-95-7   
C28H33N3O3*ClH 

[1]JournalofMedicinalChemistry,2011,vol.54,p.7477-7485

CASUnavailable 
  22525-95-7    34183-22-7 

[1]Zhan,Xiao-Yu;Zhang,Hua;Dong,Yu;Yang,Jian;He,Shuai;Shi,Zhi-Chuan;Tang,Lei;Wang,Ji-Yu[JournalofOrganicChemistry,2020,vol.85,#10,p.6578-6592]

[2]CurrentPatentAssignee:LINYIUNIVERSITY-CN111217690,2020,ALocationinpatent:Paragraph0049-0050

Literature
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Tags:22525-95-7 Molecular Formula|22525-95-7 MDL|22525-95-7 SMILES|22525-95-7 2'-(Oxiranylmethoxy)-3-phenylpropiophenone