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4-Hydroxy-TEMPO

CAT: 1489-T9540-01Size: 25 gDry Ice: NoHazardous: No
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CAT#:1489-T9540-01Size:25 g
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CAS Number
2226-96-2
Purity
0.98

Chemical Information

Tempol

4-hydroxy-TEMPO is a member of the class of aminoxyls that is TEMPO carrying a hydroxy substituent at position 4. It is a radical scavenger which exhibits anti-inflammatory and analgesic properties. It has a role as a catalyst, an antineoplastic agent, a radical scavenger, a hepatoprotective agent, a neuroprotective agent, an anti-inflammatory agent, an apoptosis inducer and a nephroprotective agent. It is a member of aminoxyls and a hydroxypiperidine. It is functionally related to a TEMPO.

CAS Number2226-96-2
PubChem CID137994
Molecular FormulaC9H18NO2
Molecular Weight172.24
XLogP0.9
Topological Polar Surface Area24.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Heavy Atom Count12
Formal Charge0
Complexity159
SMILES
CC1(CC(CC(N1[O])(C)C)O)C
InChI
InChI=1S/C9H18NO2/c1-8(2)5-7(11)6-9(3,4)10(8)12/h7,11H,5-6H2,1-4H3
InChIKey
UZFMOKQJFYMBGY-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Tempol
CAS: 2226-96-2
CID: 137994
Formula: C9H18NO2
MW: 172.24
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight172.24
XLogP30.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Exact Mass172.133753817
Monoisotopic Mass172.133753817
Topological Polar Surface Area24.5 Ų
Heavy Atom Count12
Formal Charge0
Complexity159
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