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Safety Information

615080

Sigma-Aldrich

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

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.

Pictograms

FlameExclamation mark

Signal Word

Danger

Hazard 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


Regulatory Listings

Regulatory Listings are mainly provided for chemical products. Only limited information can be provided here for non-chemical products. No entry means none of the components are listed. It is the user’s obligation to ensure the safe and legal use of the product.

FSL

Group 4: Flammable liquids
Alcohols
Hazardous rank II

ISHL Indicated Name

Substances Subject to be Indicated Names

ISHL Notified Names

Substances Subject to be Notified Names

JAN Code

615080-5G-PW:
615080-5G:
615080-VAR:
615080-25G:
615080-BULK:


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Customers Also Viewed

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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