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219763-06-1,MFCD06589810
Catalog No.:AA00BDJD

219763-06-1 | 2-Methyl-1-benzofuran-5-carboxylic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
95%
in stock  
$245.00   $172.00
- +
5g
95%
in stock  
$978.00   $685.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00BDJD
Chemical Name:
2-Methyl-1-benzofuran-5-carboxylic acid
CAS Number:
219763-06-1
Molecular Formula:
C10H8O3
Molecular Weight:
176.1687
MDL Number:
MFCD06589810
SMILES:
Cc1oc2c(c1)cc(cc2)C(=O)O
Properties
Computed Properties
 
Complexity:
214  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
1  
XLogP3:
2.3  

Downstream Synthesis Route

[1]CurrentPatentAssignee:ASTELLASPHARMAINC.-US6348474,2002,B1Locationinpatent:Pagecolumn65

[1]CurrentPatentAssignee:ASTELLASPHARMAINC.-US6348474,2002,B1Locationinpatent:Pagecolumn65,66

[1]CurrentPatentAssignee:PFIZERINC-US2003/232853,2003,A1Locationinpatent:Page40

[1]CurrentPatentAssignee:PFIZERINC-US2003/105089,2003,A1

[1]CurrentPatentAssignee:AKAALPHARMA-WO2010/42998,2010,A1Locationinpatent:Page/Pagecolumn104;105

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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Tags:219763-06-1 Molecular Formula|219763-06-1 MDL|219763-06-1 SMILES|219763-06-1 2-Methyl-1-benzofuran-5-carboxylic acid