615080
2-Propanol-OD
98 atom % D
Synonym(s):
2-Propan(ol-d), Isopropanol-OD, Isopropyl alcoh(ol-d)
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About This Item
Linear Formula:
(CH3)2CHOD
CAS Number:
Molecular Weight:
61.10
EC Number:
MDL number:
UNSPSC Code:
12142201
PubChem Substance ID:
NACRES:
NA.12
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isotopic purity
98 atom % D
Quality Level
Assay
99% (CP)
refractive index
n20/D 1.3752 (lit.)
bp
82 °C (lit.)
mp
-90 °C (lit.)
density
0.798 g/mL at 25 °C (lit.)
mass shift
M+1
SMILES string
[2H]OC(C)C
InChI
1S/C3H8O/c1-3(2)4/h3-4H,1-2H3/i4D
InChI key
KFZMGEQAYNKOFK-QYKNYGDISA-N
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General description
2-Propanol-OD, isotopically labeled analogue of 2-propanol.
Application
2-Propanol- OD is used as a solvent to study the reaction mechanism of benzophenone and/or acetone ketyl radicals with tirapazamine, which is used to examined the exact mechanism of DNA damage and repair. Also, it is used to monitor the solvation of carbene compounds from dynamic study.
2-Propanol-OD can be used as a solvent in the study of:
- Solvation time (dynamics) of singlet carbene compounds.
- Reaction mechanism of benzophenone and/or acetone ketyl radicals with tirapazamine.
Packaging
This product may be available from bulk stock and can be packaged on demand. For information on pricing, availability and packaging, please contact Stable Isotopes Customer Service.
Signal Word
Danger
Hazard Statements
Precautionary Statements
Hazard Classifications
Eye Irrit. 2 - Flam. Liq. 2 - STOT SE 3
Target Organs
Central nervous system
Storage Class Code
3 - Flammable liquids
WGK
WGK 1
Flash Point(F)
53.6 °F - closed cup
Flash Point(C)
12.0 °C - closed cup
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Xiaofeng Shi et al.
Journal of the American Chemical Society, 129(15), 4542-4550 (2007-03-27)
Ketyl radicals produced by photolysis of ketones or di-tert-butyl peroxide (DTBP) in alcohol solvents react rapidly with tirapazamine (TPZ). The acetone ketyl radical (ACOH) reacts with TPZ with an absolute second-order rate constant of (9.7 +/- 0.4) x 108 M-1
On the mechanism of reaction of radicals with tirapazamine
Shi X, et al.
Journal of the American Chemical Society, 129(15), 4542-4550 (2007)
The dynamics of carbene solvation: an ultrafast study of p-biphenylyltrifluoromethylcarbene
Wang J, et al.
Journal of the American Chemical Society, 130(7), 2304-2313 (2008)
Jin Wang et al.
Journal of the American Chemical Society, 130(7), 2304-2313 (2008-01-25)
Ultrafast photolysis (lambda(ex) = 308 nm) of p-biphenylyltrifluoromethyl diazomethane (BpCN2CF3) releases singlet p-biphenylyltrifluoromethylcarbene (BpCCF3) which absorbs strongly at 385 nm in cyclohexane, immediately after the 300 fs laser pulse. The initial absorption maximum shifts to longer wavelengths in coordinating solvents
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