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52043-21-7,MFCD03422214
Catalog No.:AA00DASU

52043-21-7 | 2-(2,4-Difluorophenoxy)propanoic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
5g
95%
in stock  
$978.00   $685.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA00DASU
Chemical Name:
2-(2,4-Difluorophenoxy)propanoic acid
CAS Number:
52043-21-7
Molecular Formula:
C9H8F2O3
Molecular Weight:
202.1548
MDL Number:
MFCD03422214
SMILES:
OC(=O)C(Oc1ccc(cc1F)F)C
Properties
Properties
 
Storage:
Keep in dry area;2-8℃;  

Computed Properties
 
Complexity:
210  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0  
Rotatable Bond Count:
3  
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0  
XLogP3:
2.4  

Downstream Synthesis Route
52043-21-7    139200-39-8   
C14H15F2NO4 

[1]Kathman,StefanG.;Xu,Ziyang;Statsyuk,AlexanderV.[JournalofMedicinalChemistry,2014,vol.57,#11,p.4969-4974]

2620-50-0    52043-21-7   
N-3,4-(methylenedioxy)benzyl-2-(2,4-difluorophenoxy)propanamide 

[1]Williams,JohnD.;Torhan,MatthewC.;Neelagiri,VenugopalR.;Brown,Carson;Bowlin,NicholasO.;Di,Ming;McCarthy,CourtneyT.;Aiello,Daniel;Peet,NortonP.;Bowlin,TerryL.;Moir,DonaldT.[BioorganicandMedicinalChemistry,2015,vol.23,#5,p.1027-1043]

[1]Williams,JohnD.;Torhan,MatthewC.;Neelagiri,VenugopalR.;Brown,Carson;Bowlin,NicholasO.;Di,Ming;McCarthy,CourtneyT.;Aiello,Daniel;Peet,NortonP.;Bowlin,TerryL.;Moir,DonaldT.[BioorganicandMedicinalChemistry,2015,vol.23,#5,p.1027-1043]

[1]Williams,JohnD.;Torhan,MatthewC.;Neelagiri,VenugopalR.;Brown,Carson;Bowlin,NicholasO.;Di,Ming;McCarthy,CourtneyT.;Aiello,Daniel;Peet,NortonP.;Bowlin,TerryL.;Moir,DonaldT.[BioorganicandMedicinalChemistry,2015,vol.23,#5,p.1027-1043]

52043-21-7   
C10H17NO4*C2HF3O2 
 
C14H15F2NO4 

[1]McShan,Danielle;Kathman,Stefan;Lowe,Brittiney;Xu,Ziyang;Zhan,Jennifer;Statsyuk,Alexander;Ogungbe,IfedayoVictor[BioorganicandMedicinalChemistryLetters,2015,vol.25,#20,p.4509-4512]

Literature
Quotation Request
Company Name:
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SDS
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Tags:52043-21-7 Molecular Formula|52043-21-7 MDL|52043-21-7 SMILES|52043-21-7 2-(2,4-Difluorophenoxy)propanoic acid
Catalog No.: AA00DASU
52043-21-7,MFCD03422214
52043-21-7 | 2-(2,4-Difluorophenoxy)propanoic acid
Pack Size： 5g
Purity： 95%
in stock
$978.00 $685.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA00DASU
Chemical Name: 2-(2,4-Difluorophenoxy)propanoic acid
CAS Number: 52043-21-7
Molecular Formula: C9H8F2O3
Molecular Weight: 202.1548
MDL Number: MFCD03422214
SMILES: OC(=O)C(Oc1ccc(cc1F)F)C
Properties
Storage: Keep in dry area;2-8℃;  
Complexity: 210  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 14  
Hydrogen Bond Acceptor Count: 5  
Hydrogen Bond Donor Count: 1  
Isotope Atom Count: 0  
Rotatable Bond Count: 3  
Undefined Atom Stereocenter Count: 1  
Undefined Bond Stereocenter Count: 0  
XLogP3: 2.4  
Downstream Synthesis Route
52043-21-7    139200-39-8   
C14H15F2NO4 

[1]Kathman,StefanG.;Xu,Ziyang;Statsyuk,AlexanderV.[JournalofMedicinalChemistry,2014,vol.57,#11,p.4969-4974]

2620-50-0    52043-21-7   
N-3,4-(methylenedioxy)benzyl-2-(2,4-difluorophenoxy)propanamide 

[1]Williams,JohnD.;Torhan,MatthewC.;Neelagiri,VenugopalR.;Brown,Carson;Bowlin,NicholasO.;Di,Ming;McCarthy,CourtneyT.;Aiello,Daniel;Peet,NortonP.;Bowlin,TerryL.;Moir,DonaldT.[BioorganicandMedicinalChemistry,2015,vol.23,#5,p.1027-1043]

367-27-1    52043-21-7 

[1]Williams,JohnD.;Torhan,MatthewC.;Neelagiri,VenugopalR.;Brown,Carson;Bowlin,NicholasO.;Di,Ming;McCarthy,CourtneyT.;Aiello,Daniel;Peet,NortonP.;Bowlin,TerryL.;Moir,DonaldT.[BioorganicandMedicinalChemistry,2015,vol.23,#5,p.1027-1043]

1052722-39-0    52043-21-7 

[1]Williams,JohnD.;Torhan,MatthewC.;Neelagiri,VenugopalR.;Brown,Carson;Bowlin,NicholasO.;Di,Ming;McCarthy,CourtneyT.;Aiello,Daniel;Peet,NortonP.;Bowlin,TerryL.;Moir,DonaldT.[BioorganicandMedicinalChemistry,2015,vol.23,#5,p.1027-1043]

52043-21-7   
C10H17NO4*C2HF3O2 
 
C14H15F2NO4 

[1]McShan,Danielle;Kathman,Stefan;Lowe,Brittiney;Xu,Ziyang;Zhan,Jennifer;Statsyuk,Alexander;Ogungbe,IfedayoVictor[BioorganicandMedicinalChemistryLetters,2015,vol.25,#20,p.4509-4512]

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