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117685-48-0,MFCD03425825
Catalog No.:AA0077HX

117685-48-0 | 6-Fluoro-4-oxo-1,4-dihydro-3-quinolinecarboxylic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
98
in stock  
$161.00   $113.00
- +
5g
98%
in stock  
$758.00 $530.00
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA0077HX
Chemical Name:
6-Fluoro-4-oxo-1,4-dihydro-3-quinolinecarboxylic acid
CAS Number:
117685-48-0
Molecular Formula:
C10H6FNO3
Molecular Weight:
207.1579
MDL Number:
MFCD03425825
SMILES:
Fc1ccc2c(c1)c(=O)c(c[nH]2)C(=O)O
Properties
Computed Properties
 
Complexity:
340  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0  
Rotatable Bond Count:
1  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
1.9  

Synonyms
 
  
Downstream Synthesis Route
1182822-31-6    117685-48-0   
C26H29FN2O5 

[1]Zhu,Jun;He,Lin;Ma,Liang;Wei,Zhe;He,Jiqiang;Yang,Zhuang;Pu,Yuzhi;Cao,Dong;Wu,Yuzhe;Xiang,Mingli;Peng,Aihua;Wei,Yuquan;Chen,Lijuan[BioorganicandMedicinalChemistryLetters,2014,vol.24,#24,p.5666-5670]

[1]Zhu,Jun;He,Lin;Ma,Liang;Wei,Zhe;He,Jiqiang;Yang,Zhuang;Pu,Yuzhi;Cao,Dong;Wu,Yuzhe;Xiang,Mingli;Peng,Aihua;Wei,Yuquan;Chen,Lijuan[BioorganicandMedicinalChemistryLetters,2014,vol.24,#24,p.5666-5670]

Literature

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

Journal: Bioorganic & medicinal chemistry letters 20101101

Title: Free-radical-induced oxidative and reductive degradation of fluoroquinolone pharmaceuticals: kinetic studies and degradation mechanism.

Journal: The journal of physical chemistry. A 20090709

Title: Evaluation of 3-carboxy-4(1H)-quinolones as inhibitors of human protein kinase CK2.

Journal: Journal of medicinal chemistry 20061102

Title: Microsphere-based protease assays and screening application for lethal factor and factor Xa.

Journal: Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501

Title: Synthesis of 6-fluoro-1,4-dihydro-4-oxo-quinoline-3-carboxylic acid derivatives as potential antimicrobial agents.

Journal: European journal of medicinal chemistry 20030101

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SDS
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Tags:117685-48-0 Molecular Formula|117685-48-0 MDL|117685-48-0 SMILES|117685-48-0 6-Fluoro-4-oxo-1,4-dihydro-3-quinolinecarboxylic acid
Catalog No.: AA0077HX
117685-48-0,MFCD03425825
117685-48-0 | 6-Fluoro-4-oxo-1,4-dihydro-3-quinolinecarboxylic acid
Pack Size： 1g
Purity： 98
in stock
$161.00 $113.00
Pack Size： 5g
Purity： 98%
in stock
$758.00 $530.00
Quantity
- +
Add to Card
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bulk Quotation Request
Technical Information
Catalog Number: AA0077HX
Chemical Name: 6-Fluoro-4-oxo-1,4-dihydro-3-quinolinecarboxylic acid
CAS Number: 117685-48-0
Molecular Formula: C10H6FNO3
Molecular Weight: 207.1579
MDL Number: MFCD03425825
SMILES: Fc1ccc2c(c1)c(=O)c(c[nH]2)C(=O)O
Properties
Complexity: 340  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 15  
Hydrogen Bond Acceptor Count: 5  
Hydrogen Bond Donor Count: 2  
Isotope Atom Count: 0  
Rotatable Bond Count: 1  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 1.9  
97:   
Downstream Synthesis Route
1182822-31-6    117685-48-0   
C26H29FN2O5 

[1]Zhu,Jun;He,Lin;Ma,Liang;Wei,Zhe;He,Jiqiang;Yang,Zhuang;Pu,Yuzhi;Cao,Dong;Wu,Yuzhe;Xiang,Mingli;Peng,Aihua;Wei,Yuquan;Chen,Lijuan[BioorganicandMedicinalChemistryLetters,2014,vol.24,#24,p.5666-5670]

1182822-31-6    117685-48-0    873051-19-5 

[1]Zhu,Jun;He,Lin;Ma,Liang;Wei,Zhe;He,Jiqiang;Yang,Zhuang;Pu,Yuzhi;Cao,Dong;Wu,Yuzhe;Xiang,Mingli;Peng,Aihua;Wei,Yuquan;Chen,Lijuan[BioorganicandMedicinalChemistryLetters,2014,vol.24,#24,p.5666-5670]

Literature fold

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

Journal: Bioorganic & medicinal chemistry letters20101101

Title: Free-radical-induced oxidative and reductive degradation of fluoroquinolone pharmaceuticals: kinetic studies and degradation mechanism.

Journal: The journal of physical chemistry. A20090709

Title: Evaluation of 3-carboxy-4(1H)-quinolones as inhibitors of human protein kinase CK2.

Journal: Journal of medicinal chemistry20061102

Title: Microsphere-based protease assays and screening application for lethal factor and factor Xa.

Journal: Cytometry. Part A : the journal of the International Society for Analytical Cytology20060501

Title: Synthesis of 6-fluoro-1,4-dihydro-4-oxo-quinoline-3-carboxylic acid derivatives as potential antimicrobial agents.

Journal: European journal of medicinal chemistry20030101

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