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Norfloxacin Impurity 7

CAT: 1299-RM-N062433-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:1299-RM-N062433-01Size:10 mg
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CAS Number
106847-39-6
Synonyms
Ethyl 5-chloro-1-ethyl-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylate
Molecular Formula
C14H13ClFNO3
Molecular Weight
297.71
Target Alternative Name
Norfloxacin
Product Name Synonym
Ethyl 5-chloro-1-ethyl-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylate

Chemical Information

Ethyl 5-chloro-1-ethyl-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylate
CAS Number106847-39-6
PubChem CID639068
IUPAC Nameethyl 5-chloro-1-ethyl-6-fluoro-4-oxoquinoline-3-carboxylate
Molecular FormulaC14H13ClFNO3
Molecular Weight297.71
XLogP3.2
Topological Polar Surface Area46.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Heavy Atom Count20
Formal Charge0
Complexity440
SMILES
CCN1C=C(C(=O)C2=C1C=CC(=C2Cl)F)C(=O)OCC
InChI
InChI=1S/C14H13ClFNO3/c1-3-17-7-8(14(19)20-4-2)13(18)11-10(17)6-5-9(16)12(11)15/h5-7H,3-4H2,1-2H3
InChIKey
QRBZOAJRQAERSN-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Ethyl 5-chloro-1-ethyl-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylate
CAS: 106847-39-6
CID: 639068
Formula: C14H13ClFNO3
MW: 297.71
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight297.71
XLogP33.2
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Exact Mass297.0567991
Monoisotopic Mass297.0567991
Topological Polar Surface Area46.6 Ų
Heavy Atom Count20
Formal Charge0
Complexity440
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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