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Norfloxacin Impurity 42

CAT: 1299-RM-N062470-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:1299-RM-N062470-01Size:10 mg
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CAS Number
75073-15-3
Synonyms
Ethyl 7-chloro-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylate
Molecular Formula
C12H9ClFNO3
Molecular Weight
269.66
Target Alternative Name
Norfloxacin
Product Name Synonym
Ethyl 7-chloro-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylate

Chemical Information

7-Chloro-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid, ethyl ester
CAS Number75073-15-3
PubChem CID3018009
IUPAC Nameethyl 7-chloro-6-fluoro-4-oxo-1H-quinoline-3-carboxylate
Molecular FormulaC12H9ClFNO3
Molecular Weight269.65
XLogP2.7
Topological Polar Surface Area55.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count3
Heavy Atom Count18
Formal Charge0
Complexity399
SMILES
CCOC(=O)C1=CNC2=CC(=C(C=C2C1=O)F)Cl
InChI
InChI=1S/C12H9ClFNO3/c1-2-18-12(17)7-5-15-10-4-8(13)9(14)3-6(10)11(7)16/h3-5H,2H2,1H3,(H,15,16)
InChIKey
VLOYRWBXBBOLJW-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 7-Chloro-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid, ethyl ester
CAS: 75073-15-3
CID: 3018009
Formula: C12H9ClFNO3
MW: 269.65
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight269.65
XLogP32.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count3
Exact Mass269.0254990
Monoisotopic Mass269.0254990
Topological Polar Surface Area55.4 Ų
Heavy Atom Count18
Formal Charge0
Complexity399
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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