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Merck
CN

46212

3-Methyl-2-butanone

analytical standard

Synonym(s):

Isopropyl methyl ketone, Methyl isopropyl ketone

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About This Item

Linear Formula:
(CH3)2CHCOCH3
CAS Number:
563-80-4
Molecular Weight:
86.13
EC Number:
209-264-3
UNSPSC Code:
41116107
PubChem Substance ID:
329757105
Beilstein/REAXYS Number:
1071238
MDL number:
MFCD00008919

Key Documents

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InChI key

SYBYTAAJFKOIEJ-UHFFFAOYSA-N

InChI

1S/C5H10O/c1-4(2)5(3)6/h4H,1-3H3

SMILES string

CC(C)C(C)=O

grade

analytical standard

assay

98-100%

shelf life

limited shelf life, expiry date on the label

technique(s)

HPLC: suitable, gas chromatography (GC): suitable

bp

94-95 °C (lit.)

mp

−92 °C (lit.)

density

0.805 g/mL at 25 °C (lit.)

application(s)

cleaning products
cosmetics
environmental
flavors and fragrances
food and beverages
personal care

format

neat

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Application

Refer to the product′s Certificate of Analysis for more information on a suitable instrument technique. Contact Technical Service for further support.

pictograms

Flame
GHS02

signalword

Danger

hcodes

H225

Hazard Classifications

Flam. Liq. 2

Storage Class

3 - Flammable liquids

wgk

WGK 1

flash_point_f

30.2 °F

flash_point_c

-1 °C

ppe

Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter

Regulatory Information

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Certificates of Analysis (COA)

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Sami Sajjadifar et al.
Molecules (Basel, Switzerland), 15(4), 2491-2498 (2010-04-30)
Methyl indolenines (4a-c) and(5a-c) were prepared in high yield by a Fischer indole synthesis reaction of o,m-tolylhydrazine hydrochlorides (1a-b) with isopropyl methyl ketone (2) and 2-methylcyclohexanone (3) in acetic acid at room temperature. o,p- Nitrophenylhydrazines (1c-d) were reacted with 2-methylcyclohexanone
E M Gagan et al.
Archives of environmental contamination and toxicology, 52(3), 283-293 (2007-01-27)
Frequently the toxicity of an organic chemical mixture is close to dose-additive, even when the agents are thought to induce toxicity at different molecular sites of action. These findings appear to conflict with the hypothesis that a strictly dose-additive combined
Potential anticonvulsants IV: Condensation of isatin with benzoylacetone and isopropyl methyl ketone.
F D Popp et al.
Journal of pharmaceutical sciences, 71(9), 1052-1054 (1982-09-01)
S Schnell et al.
Biodegradation, 2(1), 33-41 (1991-01-01)
Strictly anaerobic bacteria were enriched and isolated from freshwater sediment sources in the presence and absence of sulfate with sorbic acid as sole source of carbon and energy. Strain WoSo1, a Gram-negative vibrioid sulfate-reducing bacterium which was assigned to the

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