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2- (4-Fluorophenyl) -2-propanol

CAT: 0024-sc-282661Size: 1 gDry Ice: NoHazardous: No
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CAT#:0024-sc-282661Size:1 g
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CAS Number
402-41-5

Chemical Information

2-(4-Fluorophenyl)-2-propanol
CAS Number402-41-5
PubChem CID637733
IUPAC Name2-(4-fluorophenyl)propan-2-ol
Molecular FormulaC9H11FO
Molecular Weight154.18
XLogP1.7
Topological Polar Surface Area20.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Heavy Atom Count11
Formal Charge0
Complexity126
SMILES
CC(C)(C1=CC=C(C=C1)F)O
InChI
InChI=1S/C9H11FO/c1-9(2,11)7-3-5-8(10)6-4-7/h3-6,11H,1-2H3
InChIKey
QURXIISLVHJNGB-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-(4-Fluorophenyl)-2-propanol
CAS: 402-41-5
CID: 637733
Formula: C9H11FO
MW: 154.18
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight154.18
XLogP31.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Exact Mass154.079393132
Monoisotopic Mass154.079393132
Topological Polar Surface Area20.2 Ų
Heavy Atom Count11
Formal Charge0
Complexity126
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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