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1- (4-Fluorophenyl) -2-phenylethanone

CAT: 0024-sc-258465ASize: 5 gDry Ice: NoHazardous: No
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CAT#:0024-sc-258465ASize:5 g
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CAS Number
347-84-2

Chemical Information

1-(4-Fluorophenyl)-2-phenylethan-1-one
CAS Number347-84-2
PubChem CID318235
IUPAC Name1-(4-fluorophenyl)-2-phenylethanone
Molecular FormulaC14H11FO
Molecular Weight214.23
XLogP3.3
Topological Polar Surface Area17.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count3
Heavy Atom Count16
Formal Charge0
Complexity225
SMILES
C1=CC=C(C=C1)CC(=O)C2=CC=C(C=C2)F
InChI
InChI=1S/C14H11FO/c15-13-8-6-12(7-9-13)14(16)10-11-4-2-1-3-5-11/h1-9H,10H2
InChIKey
YFYKGCQUWKAFLW-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1-(4-Fluorophenyl)-2-phenylethan-1-one
CAS: 347-84-2
CID: 318235
Formula: C14H11FO
MW: 214.23
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight214.23
XLogP33.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count3
Exact Mass214.079393132
Monoisotopic Mass214.079393132
Topological Polar Surface Area17.1 Ų
Heavy Atom Count16
Formal Charge0
Complexity225
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