4-Benzoyloxy-2,2,6,6-tetramethylpiperidine 1-Oxyl
Product Information
Molecular Formula
C17H24NO2*
Molecular Weight
276.35
Description
4-hydroxy-TEMPO benzoate is a member of the class of piperidines that is TEMPO carrying a benzoyloxy group at position 4. It has a role as a radical scavenger and a spin probe. It is a member of aminoxyls, a member of piperidines and a benzoate ester. It is functionally related to a 4-hydroxy-TEMPO.
Synonyms
4-Hydroxy-TEMPO Benzoate Free Radical,4-Benzoyloxy-2,2,6,6-tetramethylpiperidine 1-Oxyl Free Radical,4-Benzoyloxy-TEMPO Free Radical
SMILES
CC1(CC(CC(N1[O])(C)C)OC(=O)C2=CC=CC=C2)C
InChI
InChI=1S/C16H22NO3/c1-15(2)10-13(11-16(3,4)17(15)19)20-14(18)12-8-6-5-7-9-12/h5-9,13H,10-11H2,1-4H3
InChI Key
MJEDTBDGYVATPI-UHFFFAOYSA-N
Melting Point
104 °C
Purity
>97.0%
Appearance
Light yellow to Brown powder to crystal
Computed Properties
XLogP3
3.1
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
3
Rotatable Bond Count
3
Exact Mass
276.15996856 g/mol
Monoisotopic Mass
276.15996856 g/mol
Topological Polar Surface Area
30.5Ų
Heavy Atom Count
20
Formal Charge
0
Complexity
341
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
Covalently-Bonded Unit Count
1
Compound Is Canonicalized
Yes
Patents
| Publication Number | Title | Priority Date |
|---|---|---|
| US-2011111258-A1 | Radiation-curable vinyl chloride copolymer, radiation-curable composition, and magnetic recording medium | 2009-11-12 |
| US-2011027620-A1 | Radiation-curable polyurethane resin composition and magnetic recording medium using the same | 2009-07-31 |
| US-2009093601-A1 | Photochromic Compounds Comprising Polymeric Substituents And Methods For Preparation And Use Thereof | 2004-09-02 |
| US-2007187656-A1 | Photochromic compositions and articles comprising siloxane, alkylene or substituted alkylene oligomers | 2004-04-30 |
| US-2003198801-A1 | Ink-jet media porous coatings with chemically attached active ligands | 2002-04-10 |
| US-6433100-B1 | Process for the preparation of polymers containing N-O terminal groups | 1998-09-29 |
| US-6348598-B1 | N-oxyl compounds, process for the preparation thereof, and process for inhibiting the polymerization of vinyl monomers with the same | 1997-11-12 |
| US-2002002313-A1 | Process for preparation of hydroperoxides | 1997-07-09 |
| US-6291718-B1 | Process for preparing hydroperoxides | 1997-07-09 |
| US-6476276-B2 | Process for preparation of hydroperoxides | 1997-07-09 |
