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334017-34-4,MFCD06005852
Catalog No.:AA003M0Y

334017-34-4 | 5-(2-Chlorophenyl)isoxazole-3-carboxylic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
100mg
98+%
in stock  
$9.00   $7.00
- +
250mg
98+%
in stock  
$16.00   $11.00
- +
1g
98+%
in stock  
$62.00   $43.00
- +
5g
98+%
in stock  
$289.00   $203.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA003M0Y
Chemical Name:
5-(2-Chlorophenyl)isoxazole-3-carboxylic acid
CAS Number:
334017-34-4
Molecular Formula:
C10H6ClNO3
Molecular Weight:
223.6125
MDL Number:
MFCD06005852
SMILES:
Clc1ccccc1c1onc(c1)C(=O)O
Properties
Properties
 
Form:
Solid  
Storage:
Keep in dry area;2-8℃;  

Computed Properties
 
Complexity:
249  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
2  
XLogP3:
2.5  

Downstream Synthesis Route

[1]CurrentPatentAssignee:EISAICOLTD-EP1394147,2004,A1Locationinpatent:Page46

[1]CurrentPatentAssignee:EISAICOLTD-EP1394147,2004,A1Locationinpatent:Page55

4-(2-chloro-phenyl)-but-3-en-2-oneoxime 
  334017-34-4 

[1]Desai,VidyaG.;Naik,SnehaR.;Dhumaskar,KashinathL.[SyntheticCommunications,2014,vol.44,#10,p.1453-1460]

2-chlorobenzalacetone 
  334017-34-4 

[1]Desai,VidyaG.;Naik,SnehaR.;Dhumaskar,KashinathL.[SyntheticCommunications,2014,vol.44,#10,p.1453-1460]

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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