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Fenoxazoline

CAT: 0013-GTR19258704-02Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19258704-02Size:10 mg
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Description
Fenoxazoline is utilized as both a decongestant and a vasoconstrictor.
CAS Number
4846-91-7
Field of Research
Pharmacology & Drug Discovery
Smiles
N1=C (NCC1) COC=2C=CC=CC2C (C) C
Molecular Formula
C13H18N2O
Molecular Weight
218.295
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Fenoxazoline

Fenoxazoline is an alkylbenzene.

CAS Number4846-91-7
PubChem CID71899
IUPAC Name2-[(2-propan-2-ylphenoxy)methyl]-4,5-dihydro-1H-imidazole
Molecular FormulaC13H18N2O
Molecular Weight218.29
XLogP2
Topological Polar Surface Area33.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count4
Heavy Atom Count16
Formal Charge0
Complexity250
SMILES
CC(C)C1=CC=CC=C1OCC2=NCCN2
InChI
InChI=1S/C13H18N2O/c1-10(2)11-5-3-4-6-12(11)16-9-13-14-7-8-15-13/h3-6,10H,7-9H2,1-2H3,(H,14,15)
InChIKey
GFYSWQDCHLWRMQ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Fenoxazoline
CAS: 4846-91-7
CID: 71899
Formula: C13H18N2O
MW: 218.29
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight218.29
XLogP32
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count4
Exact Mass218.141913202
Monoisotopic Mass218.141913202
Topological Polar Surface Area33.6 Ų
Heavy Atom Count16
Formal Charge0
Complexity250
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

Alternative Products

CatalogName
T206187-01Fenoxazoline

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