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4-Benzyl-4-hydroxypiperidine

CAT: 0013-GTR19252364-01Size: 200 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19252364-01Size:200 mg
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Description
4-Benzyl-4-hydroxypiperidine
CAS Number
51135-96-7
Smiles
OC1 (CC2=CC=CC=C2) CCNCC1
Molecular Formula
C12H17NO
Molecular Weight
191.27
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

4-Benzyl-4-piperidinol
CAS Number51135-96-7
PubChem CID98152
IUPAC Name4-benzylpiperidin-4-ol
Molecular FormulaC12H17NO
Molecular Weight191.27
XLogP1.4
Topological Polar Surface Area32.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Heavy Atom Count14
Formal Charge0
Complexity169
SMILES
C1CNCCC1(CC2=CC=CC=C2)O
InChI
InChI=1S/C12H17NO/c14-12(6-8-13-9-7-12)10-11-4-2-1-3-5-11/h1-5,13-14H,6-10H2
InChIKey
KJZBZOFESQSBCV-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 4-Benzyl-4-piperidinol
CAS: 51135-96-7
CID: 98152
Formula: C12H17NO
MW: 191.27
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight191.27
XLogP31.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Exact Mass191.131014166
Monoisotopic Mass191.131014166
Topological Polar Surface Area32.3 Ų
Heavy Atom Count14
Formal Charge0
Complexity169
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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