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Home Fluorides 162401-59-4
162401-59-4,MFCD03964657
Catalog No.:AA00APCG

162401-59-4 | 4-(Difluoromethoxy)-3-methoxybenzoic acid

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1g
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$570.00   $399.00
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00APCG
Chemical Name:
4-(Difluoromethoxy)-3-methoxybenzoic acid
CAS Number:
162401-59-4
Molecular Formula:
C9H8F2O4
Molecular Weight:
218.1542
MDL Number:
MFCD03964657
SMILES:
COc1cc(ccc1OC(F)F)C(=O)O
Properties
Computed Properties
 
Complexity:
222  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
4  
XLogP3:
2.6  

Downstream Synthesis Route

[1]CurrentPatentAssignee:ASTRAZENECAPLC-US5712298,1998,A

162401-59-4   
C18H17F4N3O3 
 
C27H23F6N3O6 

[1]CurrentPatentAssignee:ENANTAPHARMACEUTICALSINC-WO2021/66922,2021,A1Locationinpatent:Page/Pagecolumn65;66;91;92

162401-59-4   
C22H25F4N3O2 
 
C31H31F6N3O5 

[1]CurrentPatentAssignee:ENANTAPHARMACEUTICALSINC-WO2021/66922,2021,A1Locationinpatent:Page/Pagecolumn65;66;80

Literature
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SDS
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Tags:162401-59-4 Molecular Formula|162401-59-4 MDL|162401-59-4 SMILES|162401-59-4 4-(Difluoromethoxy)-3-methoxybenzoic acid