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Moxifloxacin Impurity 5

CAT: 1299-RM-M160236-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:1299-RM-M160236-01Size:10 mg
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CAS Number
143158-55-8
Synonyms
1-cyclopropyl-8-ethoxy-6,7-difluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid
Molecular Formula
C15H13F2NO4
Molecular Weight
309.26
Target Alternative Name
Moxifloxacin
Product Name Synonym
1-cyclopropyl-8-ethoxy-6,7-difluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid

Chemical Information

1-Cyclopropyl-8-ethoxy-6,7-difluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid
CAS Number143158-55-8
PubChem CID15284793
IUPAC Name1-cyclopropyl-8-ethoxy-6,7-difluoro-4-oxoquinoline-3-carboxylic acid
Molecular FormulaC15H13F2NO4
Molecular Weight309.26
XLogP3.1
Topological Polar Surface Area66.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count7
Rotatable Bond Count4
Heavy Atom Count22
Formal Charge0
Complexity520
SMILES
CCOC1=C2C(=CC(=C1F)F)C(=O)C(=CN2C3CC3)C(=O)O
InChI
InChI=1S/C15H13F2NO4/c1-2-22-14-11(17)10(16)5-8-12(14)18(7-3-4-7)6-9(13(8)19)15(20)21/h5-7H,2-4H2,1H3,(H,20,21)
InChIKey
OPQCGNDAHQOQPC-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1-Cyclopropyl-8-ethoxy-6,7-difluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid
CAS: 143158-55-8
CID: 15284793
Formula: C15H13F2NO4
MW: 309.26
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight309.26
XLogP33.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count7
Rotatable Bond Count4
Exact Mass309.08126422
Monoisotopic Mass309.08126422
Topological Polar Surface Area66.8 Ų
Heavy Atom Count22
Formal Charge0
Complexity520
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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