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Moxifloxacin Impurity 175

CAT: 1299-RM-M160375-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:1299-RM-M160375-01Size:10 mg
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CAS Number
116751-24-7
Synonyms
2,4,5-trifluoro-3-hydroxybenzoic acid
Molecular Formula
C7H3F3O3
Molecular Weight
192.09
Target Alternative Name
Moxifloxacin
Product Name Synonym
2,4,5-trifluoro-3-hydroxybenzoic acid

Chemical Information

2,4,5-Trifluoro-3-hydroxybenzoic Acid
CAS Number116751-24-7
PubChem CID2734270
IUPAC Name2,4,5-trifluoro-3-hydroxybenzoic acid
Molecular FormulaC7H3F3O3
Molecular Weight192.09
XLogP1.4
Topological Polar Surface Area57.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count1
Heavy Atom Count13
Formal Charge0
Complexity211
SMILES
C1=C(C(=C(C(=C1F)F)O)F)C(=O)O
InChI
InChI=1S/C7H3F3O3/c8-3-1-2(7(12)13)4(9)6(11)5(3)10/h1,11H,(H,12,13)
InChIKey
YYAFUGSJSHXYNK-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2,4,5-Trifluoro-3-hydroxybenzoic Acid
CAS: 116751-24-7
CID: 2734270
Formula: C7H3F3O3
MW: 192.09
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight192.09
XLogP31.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count1
Exact Mass192.00342844
Monoisotopic Mass192.00342844
Topological Polar Surface Area57.5 Ų
Heavy Atom Count13
Formal Charge0
Complexity211
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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