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Nebivolol Impurity 39

CAT: 1299-RM-N022239-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:1299-RM-N022239-01Size:10 mg
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CAS Number
371-41-5
Synonyms
4-fluorophenol
Molecular Formula
C6H5FO
Molecular Weight
112.1
Target Alternative Name
Nebivolol
Product Name Synonym
4-fluorophenol

Chemical Information

4-Fluorophenol

4-fluorophenol is a fluorophenol that is phenol in which the hydrogen para- to the hydroxy group has been replaced by a fluorine. It is a fluorophenol and a member of monofluorobenzenes.

CAS Number371-41-5
PubChem CID9732
IUPAC Name4-fluorophenol
Molecular FormulaC6H5FO
Molecular Weight112.10
XLogP1.8
Topological Polar Surface Area20.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Heavy Atom Count8
Formal Charge0
Complexity66
SMILES
C1=CC(=CC=C1O)F
InChI
InChI=1S/C6H5FO/c7-5-1-3-6(8)4-2-5/h1-4,8H
InChIKey
RHMPLDJJXGPMEX-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 4-Fluorophenol
CAS: 371-41-5
CID: 9732
Formula: C6H5FO
MW: 112.10
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight112.10
XLogP31.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Exact Mass112.032442941
Monoisotopic Mass112.032442941
Topological Polar Surface Area20.2 Ų
Heavy Atom Count8
Formal Charge0
Complexity66.9
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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