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487600

Sigma-Aldrich

2-Butanone-4,4,4-d3

99 atom % D

Synonym(s):

Methyl-d3 ethyl ketone

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About This Item

Linear Formula:
CD3CH2COCH3
CAS Number:
53389-26-7
Molecular Weight:
75.12
MDL number:
MFCD00142885
UNSPSC Code:
12352138
PubChem Substance ID:
24872288
NACRES:
NA.12

isotopic purity

99 atom % D

Quality Level

200

refractive index

n20/D 1.379 (lit.)

bp

80 °C (lit.)

mp

−87 °C (lit.)

density

0.838 g/mL at 25 °C

mass shift

M+3

SMILES string

[2H]C([2H])([2H])CC(C)=O

InChI

1S/C4H8O/c1-3-4(2)5/h3H2,1-2H3/i1D3

InChI key

ZWEHNKRNPOVVGH-FIBGUPNXSA-N

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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,H336

Hazard Classifications

Eye Irrit. 2 - Flam. Liq. 2 - STOT SE 3

Target Organs

Central nervous system

Supplementary Hazards

EUH066

Storage Class Code

3 - Flammable liquids

WGK

WGK 1

Flash Point(F)

30.2 °F - closed cup

Flash Point(C)

-1 °C - closed cup

Certificates of Analysis (COA)

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