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4'- (4-Fluorobenzyloxy) acetophenone

CAT: 0024-sc-262234Size: 1 gDry Ice: NoHazardous: No
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CAT#:0024-sc-262234Size:1 g
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CAS Number
72293-96-0

Chemical Information

1-[4-[(4-Fluorophenyl)methoxy]phenyl]ethanone
CAS Number72293-96-0
PubChem CID2737276
IUPAC Name1-[4-[(4-fluorophenyl)methoxy]phenyl]ethanone
Molecular FormulaC15H13FO2
Molecular Weight244.26
XLogP3.2
Topological Polar Surface Area26.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count4
Heavy Atom Count18
Formal Charge0
Complexity264
SMILES
CC(=O)C1=CC=C(C=C1)OCC2=CC=C(C=C2)F
InChI
InChI=1S/C15H13FO2/c1-11(17)13-4-8-15(9-5-13)18-10-12-2-6-14(16)7-3-12/h2-9H,10H2,1H3
InChIKey
MQJDMMIBGFVIDR-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1-[4-[(4-Fluorophenyl)methoxy]phenyl]ethanone
CAS: 72293-96-0
CID: 2737276
Formula: C15H13FO2
MW: 244.26
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight244.26
XLogP33.2
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count4
Exact Mass244.08995782
Monoisotopic Mass244.08995782
Topological Polar Surface Area26.3 Ų
Heavy Atom Count18
Formal Charge0
Complexity264
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