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487694

Sigma-Aldrich

4-Hydroxy-4-methyl-2-pentanone-d12

98 atom % D

Synonym(s):

Diacetone alcohol-d12

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About This Item

Linear Formula:
(CD3)2C(OD)CD2COCD3
CAS Number:
114253-85-9
Molecular Weight:
128.23
MDL number:
MFCD00190463
UNSPSC Code:
12352202
PubChem Substance ID:
24872295

isotopic purity

98 atom % D

Quality Level

200

assay

99% (CP)

refractive index

n20/D 1.423 (lit.)

bp

166 °C (lit.)

density

1.026 g/mL at 25 °C

mass shift

M+12

SMILES string

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

InChI

1S/C6H12O2/c1-5(7)4-6(2,3)8/h8H,4H2,1-3H3/i1D3,2D3,3D3,4D2,8D

InChI key

SWXVUIWOUIDPGS-YDUIPVTMSA-N

Related Categories

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.

signalword

Warning

Hazard Classifications

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

target_organs

Respiratory system

wgk_germany

WGK 1

flash_point_f

136.4 °F

flash_point_c

58.00 °C

Certificates of Analysis (COA)

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