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2- (Benzyloxy) -3-fluorophenol

CAT: 0127-PC1025632Size: 1 gDry Ice: NoHazardous: No
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CAT#:0127-PC1025632Size:1 g
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CAS Number
148872-80-4
MDL Number
MFCD24715292
Purity
95%
Smiles
C1ccc (c (c1F) OCc1ccccc1) O

Chemical Information

2-(Benzyloxy)-3-fluorophenol
CAS Number148872-80-4
PubChem CID10775175
IUPAC Name3-fluoro-2-phenylmethoxyphenol
Molecular FormulaC13H11FO2
Molecular Weight218.22
XLogP3.1
Topological Polar Surface Area29.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Heavy Atom Count16
Formal Charge0
Complexity204
SMILES
C1=CC=C(C=C1)COC2=C(C=CC=C2F)O
InChI
InChI=1S/C13H11FO2/c14-11-7-4-8-12(15)13(11)16-9-10-5-2-1-3-6-10/h1-8,15H,9H2
InChIKey
GFWBHWDNEMMCLC-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-(Benzyloxy)-3-fluorophenol
CAS: 148872-80-4
CID: 10775175
Formula: C13H11FO2
MW: 218.22
Interactive 3D Structure
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View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight218.22
XLogP33.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Exact Mass218.07430775
Monoisotopic Mass218.07430775
Topological Polar Surface Area29.5 Ų
Heavy Atom Count16
Formal Charge0
Complexity204
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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