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98349-25-8,MFCD01646378
Catalog No.:AA0068KD
98349-25-8 | Ethyl 1-cyclopropyl-6,7-difluoro-4-oxo-1,4-dihydroquinoline-3-carboxylate
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250mg
97%
2 weeks  
$77.00   $54.00
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1g
97%
2 weeks  
$105.00   $74.00
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5g
98%
2 weeks  
$259.00   $181.00
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Technical Information
Catalog Number:
AA0068KD
Chemical Name:
Ethyl 1-cyclopropyl-6,7-difluoro-4-oxo-1,4-dihydroquinoline-3-carboxylate
CAS Number:
98349-25-8
Molecular Formula:
C15H13F2NO3
Molecular Weight:
293.2654
MDL Number:
MFCD01646378
IUPAC Name:
ethyl 1-cyclopropyl-6,7-difluoro-4-oxoquinoline-3-carboxylate
InChI:
InChI=1S/C15H13F2NO3/c1-2-21-15(20)10-7-18(8-3-4-8)13-6-12(17)11(16)5-9(13)14(10)19/h5-8H,2-4H2,1H3
InChI Key:
QYGNYHKBMNUIJN-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1cn(C2CC2)c2c(c1=O)cc(c(c2)F)F
EC Number:
422-380-0
Properties
Computed Properties
 
Complexity:
489  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
293.086g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
293.27g/mol
Monoisotopic Mass:
293.086g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
46.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  

Synonyms
 
98349-25-8 
ETHYL 1-CYCLOPROPYL-6,7-DIFLUORO-4-OXO-1,4-DIHYDROQUINOLINE-3-CARBOXYLATE 
BCP13372 
ZINC2382962 
CL1050 
MFCD01646378 
DS-11689 
SC-82334 
AB0087343 
ETHYL 1-CYCLOPROPYL-6,7-DIFLUORO-4-OXO-1,4-DIHYDRO 
ethyl 1-cyclopropyl-6,7-difluoro-4-oxoquinoline-3-carboxylate 
ethyl 1-cyclopropyl-1,4-dihydro-6,7-difluoro-4-oxo-quinoline-3-carboxylate 
AK320542 
ethyl 1-cyclopropyl-6,7-difluoro-1,4-dihydro-4-oxo-3-quinoline-carboxylate 
ethyl 1-cyclopropyl-6,7-difluoro-1,4-dihydro-4-oxo-3-quinolinecarboxylate 
ethyl 1-cyclopropyl-6,7-difluoro-1,4-dihydro-4-oxoquinoline-3-carboxylate 
ethyl 1-cyclopropyl-6,7-difluoro-4-oxo-1,4-dihydro-3-quinolinecarboxylate 
1-cyclopropyl-6,7-difluoro- 1,4-dihydro-4-oxo-3-quinolinecarboxylic acid, ethyl ester 
1-cyclopropyl-6,7-difluoro-1,4-dihydro-4-oxo-3-quinolinecarboxylic acid, ethyl ester 
1-Cyclopropyl-6,7-difluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid ethyl ester 
CID9817544 
EC 422-380-0 
Ethyl 1-cyclopropyl-6,7-difluoro-4-oxo-quinoline-3-carboxylate 
3-Quinolinecarboxylic acid,1-cyclopropyl-6,7-difluoro-1,4-dihydro-4-oxo-, ethyl ester 
QYGNYHKBMNUIJN-UHFFFAOYSA-N 
ACMC-20m2a9 
SCHEMBL4306583 
CTK5H9824 
KS-00000PLW 
DTXSID50431269 
Literature
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