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487724

Sigma-Aldrich

4-Methyl-2-pentanone-1,1,1,3,3-d5

98 atom % D

Synonym(s):

Deuterated 4-methyl-2-pentanone, Deuterated methyl isobutyl ketone, Isopropylacetone-D5

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About This Item

Linear Formula:
(CH3)2CHCD2COCD3
CAS Number:
4840-81-7
Molecular Weight:
105.19
MDL number:
MFCD01074182
UNSPSC Code:
12352116
PubChem Substance ID:
24872299
NACRES:
NA.12

isotopic purity

98 atom % D

Quality Level

200

Assay

99% (CP)

refractive index

n20/D 1.396 (lit.)

bp

117-118 °C (lit.)

density

0.841 g/mL at 25 °C

mass shift

M+5

SMILES string

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

InChI

1S/C6H12O/c1-5(2)4-6(3)7/h5H,4H2,1-3H3/i3D3,4D2

InChI key

NTIZESTWPVYFNL-IKISXXDZSA-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.

Signal Word

Danger

Hazard Statements

H225,H319,H332,H336,H351

Hazard Classifications

Acute Tox. 4 Inhalation - Carc. 2 Inhalation - 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)

57.2 °F - closed cup

Flash Point(C)

14.00 °C - closed cup

Certificates of Analysis (COA)

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