CAS 100326-46-3|Tempol-d17

Introduction:Basic information about CAS 100326-46-3|Tempol-d17, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
Common NameTempol-d17
CAS Number100326-46-3Molecular Weight189.350
Density/Boiling Point/
Molecular FormulaC9HD17NO2Melting Point69-71ºC(lit.)
MSDSChineseUSAFlash Point/
Symbol
GHS07
Signal WordWarning

Names

Name3,3,4,5,5-pentadeuterio-1-λ1-oxidanyl-2,2,6,6-tetrakis(trideuteriomethyl)piperidin-4-ol
SynonymMore Synonyms

Tempol-d17 BiologicalActivity

DescriptionTempol-d17 is the deuterium labeled Tempol[1]. Tempol is a general superoxide dismutase (SOD)-mimetic drug that efficiently neutralizes reactive oxygen species (ROS)[2][3].
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In VitroStable heavy isotopes of hydrogen, carbon, and other elements have been incorporated into drug molecules, largely as tracers for quantitation during the drug development process. Deuteration has gained attention because of its potential to affect the pharmacokinetic and metabolic profiles of drugs[1].
References

[1]. Russak EM, et al. Impact of Deuterium Substitution on the Pharmacokinetics of Pharmaceuticals. Ann Pharmacother. 2019 Feb;53(2):211-216.  

[2]. Vilar-Pereira G, et al. Resveratrol Reverses Functional Chagas Heart Disease in Mice. PLoS Pathog. 2016 Oct 27;12(10):e1005947.  

[3]. Chatterjee PK, et al. Tempol, a membrane-permeable radical scavenger, reduces oxidant stress-mediated renal dysfunction and injury in the rat. Kidney Int. 2000 Aug58(2):658-73.  

Chemical & Physical Properties

Melting Point69-71ºC(lit.)
Molecular FormulaC9HD17NO2
Molecular Weight189.350
Exact Mass189.240463
PSA23.47000
LogP1.28370
InChIKeyUZFMOKQJFYMBGY-DEMDKEALSA-N
SMILESCC1(C)CC(O)CC(C)(C)N1[O]

Safety Information

Symbol
GHS07
Signal WordWarning
Hazard StatementsH302-H315-H319-H335
Precautionary StatementsP261-P305 + P351 + P338
RIDADRNONH for all modes of transport
WGK Germany3

Synonyms

{4-Hydroxy-2,2,6,6-tetrakis[(H)methyl](H)-1-piperidinyl}oxidanyl
4-Hydroxy-TEMPO-d17
TEMPOL-d17
4-hydroxy-2,2,6,6-tetramethylpiperidine-d17-1-oxyl
{4-Hydroxy-2,2,6,6-tetrakis[(H)methyl](H)piperidin-1-yl}oxidanyl
<2H17>4-hydroxy-2,2,6,6-tetramethylpiperidine 1-oxyl
1-Piperidinyl-3,3,4,5,5-d-oxy, 4-hydroxy-2,2,6,6-tetra(methyl-d)-
MFCD00190466
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