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Home Carboxes 31602-11-6
31602-11-6,MFCD00173388
Catalog No.:AA00C73R

31602-11-6 | 4-Chloro-8-(trifluoromethyl)quinoline-3-carboxylic ethyl ester

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
95%
in stock  
$145.00   $102.00
- +
500mg
95%
in stock  
$217.00   $152.00
- +
1g
95%
in stock  
$324.00   $227.00
- +
2.5g
95%
in stock  
$547.00   $383.00
- +
5g
95%
in stock  
$833.00   $583.00
- +
10g
95%
in stock  
$1,279.00   $895.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00C73R
Chemical Name:
4-Chloro-8-(trifluoromethyl)quinoline-3-carboxylic ethyl ester
CAS Number:
31602-11-6
Molecular Formula:
C13H9ClF3NO2
Molecular Weight:
303.6643
MDL Number:
MFCD00173388
SMILES:
CCOC(=O)c1cnc2c(c1Cl)cccc2C(F)(F)F
Properties
Computed Properties
 
Complexity:
364  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
6  
Rotatable Bond Count:
3  
XLogP3:
3.9  

Downstream Synthesis Route

[1]BioorganicandMedicinalChemistryLetters,2003,vol.13,p.1487-1490

[2]Patent:US2005/131014,2005,A1.Locationinpatent:Page/Pagecolumn28

[3]BioorganicandMedicinalChemistryLetters,2010,vol.20,p.689-693

[4]BioorganicandMedicinalChemistryLetters,2010,vol.20,p.1040-1044

[1]CurrentPatentAssignee:SUZHOUKANGRUNPHARMACEUTICALS-CN108409653,2018,A

[1]CurrentPatentAssignee:SUZHOUKANGRUNPHARMACEUTICALS-CN108409653,2018,ALocationinpatent:Paragraph0065;0077-0079

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:31602-11-6 Molecular Formula|31602-11-6 MDL|31602-11-6 SMILES|31602-11-6 4-Chloro-8-(trifluoromethyl)quinoline-3-carboxylic ethyl ester