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3-Piperidinophenol

CAT: 0127-OR28533-01Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0127-OR28533-01Size:100 mg
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CAS Number
27292-50-8
MDL Number
MFCD00053001
Purity
95%
Smiles
Oc1cccc(c1)N2CCCCC2

Chemical Information

3-(Piperidin-1-yl)phenol
CAS Number27292-50-8
PubChem CID229855
IUPAC Name3-piperidin-1-ylphenol
Molecular FormulaC11H15NO
Molecular Weight177.24
XLogP2.6
Topological Polar Surface Area23.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Heavy Atom Count13
Formal Charge0
Complexity154
SMILES
C1CCN(CC1)C2=CC(=CC=C2)O
InChI
InChI=1S/C11H15NO/c13-11-6-4-5-10(9-11)12-7-2-1-3-8-12/h4-6,9,13H,1-3,7-8H2
InChIKey
YNLRDTBLEOQPQL-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 3-(Piperidin-1-yl)phenol
CAS: 27292-50-8
CID: 229855
Formula: C11H15NO
MW: 177.24
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight177.24
XLogP32.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Exact Mass177.115364102
Monoisotopic Mass177.115364102
Topological Polar Surface Area23.5 Ų
Heavy Atom Count13
Formal Charge0
Complexity154
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