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2- (4-Fluorophenyl) propan-1-ol

CAT: 0127-PC100469-01Size: 500 mgDry Ice: NoHazardous: No
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CAT#:0127-PC100469-01Size:500 mg
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CAS Number
59667-20-8
MDL Number
MFCD16300884
Purity
95%
Smiles
CC(C1=CC=C(F)C=C1)CO

Chemical Information

2-(4-Fluorophenyl)propan-1-ol
CAS Number59667-20-8
PubChem CID12343332
IUPAC Name2-(4-fluorophenyl)propan-1-ol
Molecular FormulaC9H11FO
Molecular Weight154.18
XLogP1.9
Topological Polar Surface Area20.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Heavy Atom Count11
Formal Charge0
Complexity108
SMILES
CC(CO)C1=CC=C(C=C1)F
InChI
InChI=1S/C9H11FO/c1-7(6-11)8-2-4-9(10)5-3-8/h2-5,7,11H,6H2,1H3
InChIKey
DLIGEPKOWMTQQI-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-(4-Fluorophenyl)propan-1-ol
CAS: 59667-20-8
CID: 12343332
Formula: C9H11FO
MW: 154.18
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight154.18
XLogP31.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Exact Mass154.079393132
Monoisotopic Mass154.079393132
Topological Polar Surface Area20.2 Ų
Heavy Atom Count11
Formal Charge0
Complexity108
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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AAA701471- (4-Fluorophenyl) propan-1-ol
JCA66720-012- (4-Fluorophenyl) propan-1-ol
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