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Sigma-Aldrich

tert-Butanol-OD

99 atom % D

Synonym(s):

2-Methyl-2-propan(ol-d), tert-Butan(ol-d), tert-Butyl alcohol-d

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About This Item

Linear Formula:
(CH3)3COD
CAS Number:
3972-25-6
Molecular Weight:
75.13
EC Number:
223-597-1
MDL number:
MFCD00044421
UNSPSC Code:
12352001
PubChem Substance ID:
24850528
NACRES:
NA.12

isotopic purity

99 atom % D

Assay

99% (CP)

form

liquid

refractive index

n20/D 1.3847 (lit.)

bp

83 °C (lit.)

mp

23-26 °C (lit.)

density

0.786 g/mL at 25 °C

mass shift

M+1

SMILES string

[2H]OC(C)(C)C

InChI

1S/C4H10O/c1-4(2,3)5/h5H,1-3H3/i5D

InChI key

DKGAVHZHDRPRBM-UICOGKGYSA-N

Application

tert-Butanol-OD is a stable isotope that can be used:
  • As a model compound in the study of alcohol reactivities on MoVI and WVI oxide clusters.
  • In the synthesis of 8-deuteriocamphor.

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
GHS02,GHS07

Signal Word

Danger

Hazard Statements

H225,H319,H332,H335,H336

Hazard Classifications

Acute Tox. 4 Inhalation - Eye Irrit. 2 - Flam. Liq. 2 - STOT SE 3

Target Organs

Central nervous system, Respiratory system

Storage Class Code

3 - Flammable liquids

WGK

WGK 1

Flash Point(F)

51.8 °F - closed cup

Flash Point(C)

11 °C - closed cup

Certificates of Analysis (COA)

Search for Certificates of Analysis (COA) by entering the products Lot/Batch Number. Lot and Batch Numbers can be found on a product’s label following the words ‘Lot’ or ‘Batch’.

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Oxidation, reduction, and condensation of alcohols over (MO3) 3 (M= Mo, W) nanoclusters
Fang Z, et al.
The Journal of Physical Chemistry C, 118(39), 22620-22634 (2014)
Synthesis of camphor-1, 4-homoenol (7-hydroxy-1, 2-dimethyl [3, 3, 0, 02, 7] tricyclooctane)
Dadson WM and Money T
Canadian Journal of Chemistry, 58(23), 2524-2526 (1980)

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