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(+) -2-Fluorodeoxyarbutin

CAT: 0931-T212473-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0931-T212473-02Size:50 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1446243-88-4
Target
Tyrosinase
Related Pathways
Proteases/Proteasome
Bioactivity
(+) -2-Fluorodeoxyarbutin is a fluorinated derivative of the tyrosinase inhibitor deoxyarbutin.
Smiles
O(C1=CC(F)=C(O)C=C1)[C@@H]2CCCCO2
Molecular Formula
C11H13FO3
Molecular Weight
212.22
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

2-fluoro-4-[(2R)-oxan-2-yl]oxyphenol
CAS Number1446243-88-4
PubChem CID89682366
IUPAC Name2-fluoro-4-[(2R)-oxan-2-yl]oxyphenol
Molecular FormulaC11H13FO3
Molecular Weight212.22
XLogP2.5
Topological Polar Surface Area38.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Heavy Atom Count15
Formal Charge0
Complexity200
SMILES
C1CCO[C@@H](C1)OC2=CC(=C(C=C2)O)F
InChI
InChI=1S/C11H13FO3/c12-9-7-8(4-5-10(9)13)15-11-3-1-2-6-14-11/h4-5,7,11,13H,1-3,6H2/t11-/m1/s1
InChIKey
IBZOVBRMEKIUDK-LLVKDONJSA-N
Chemical Structure
2D Structure
2D structure of 2-fluoro-4-[(2R)-oxan-2-yl]oxyphenol
CAS: 1446243-88-4
CID: 89682366
Formula: C11H13FO3
MW: 212.22
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight212.22
XLogP32.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Exact Mass212.08487243
Monoisotopic Mass212.08487243
Topological Polar Surface Area38.7 Ų
Heavy Atom Count15
Formal Charge0
Complexity200
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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