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Home Fluorides 97914-59-5
97914-59-5,MFCD00236223
Catalog No.:AA003AZQ

97914-59-5 | 2-(Difluoromethoxy)benzoic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
98%
in stock  
$11.00   $8.00
- +
5g
98%
in stock  
$33.00   $23.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA003AZQ
Chemical Name:
2-(Difluoromethoxy)benzoic acid
CAS Number:
97914-59-5
Molecular Formula:
C8H6F2O3
Molecular Weight:
188.1282
MDL Number:
MFCD00236223
SMILES:
FC(Oc1ccccc1C(=O)O)F
Properties
Properties
 
BP:
273.6°C at 760 mmHg  
Form:
Solid  
MP:
98-100 °C  
Storage:
Keep in dry area;Room Temperature;  

Computed Properties
 
Complexity:
184  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
3  
XLogP3:
2.5  

Downstream Synthesis Route

[1]Patent:WO2008/87529,2008,A1.Locationinpatent:Page/Pagecolumn135-136

[2]EuropeanJournalofMedicinalChemistry,2014,vol.78,p.401-418

[1]Patent:US2007/49618,2007,A1.Locationinpatent:Page/Pagecolumn125

[1]Patent:WO2008/777,2008,A2.Locationinpatent:Page/Pagecolumn64

[1]EuropeanJournalofMedicinalChemistry,2014,vol.78,p.401-418

[1]EuropeanJournalofMedicinalChemistry,2014,vol.78,p.401-418

Literature

Title: Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.

Journal: Bioorganic & medicinal chemistry letters 20101101

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SDS
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