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About This Item
Linear Formula:
CH3COCH2CH2CH3
CAS Number:
Molecular Weight:
86.13
Beilstein:
506058
EC Number:
MDL number:
UNSPSC Code:
12352115
PubChem Substance ID:
Assay:
≥99%
Bp:
101-105 °C (lit.)
Vapor pressure:
27 mmHg ( 20 °C)
vapor pressure
27 mmHg ( 20 °C)
product line
ReagentPlus®
Assay
≥99%
form
liquid
autoignition temp.
941 °F
purified by
redistillation
expl. lim.
8.2 %
dilution
(for general lab use)
refractive index
n20/D 1.39 (lit.)
bp
101-105 °C (lit.)
mp
−78 °C (lit.)
solubility
water: soluble 72.6 g/L at 20 °C
density
0.809 g/mL at 25 °C (lit.)
SMILES string
CCCC(C)=O
InChI
1S/C5H10O/c1-3-4-5(2)6/h3-4H2,1-2H3
InChI key
XNLICIUVMPYHGG-UHFFFAOYSA-N
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Other Notes
A -D suffix exists for administrative purposes only.
All -D packages are 100% the same product, same quality, same specification as the package sizes previously sold without a -D.
All -D packages are 100% the same product, same quality, same specification as the package sizes previously sold without a -D.
Legal Information
ReagentPlus is a registered trademark of Merck KGaA, Darmstadt, Germany
Signal Word
Danger
Hazard Statements
Precautionary Statements
Hazard Classifications
Acute Tox. 4 Oral - Eye Irrit. 2 - Flam. Liq. 2
Storage Class Code
3 - Flammable liquids
WGK
WGK 1
Flash Point(F)
46.4 °F - closed cup
Flash Point(C)
8 °C - closed cup
Personal Protective Equipment
dust mask type N95 (US), Eyeshields, Gloves
Regulatory Information
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Toward rational design of stable, supported metal catalysts for aqueous-phase processing: Insights from the hydrogenation of levulinic acid.
Abdelrahman OA, et al.
J. Catal., 329, 10-21 (2015)
Infinite-dilution binary diffusion coefficients of 2-propanone, 2-butanone, 2-pentanone, and 3-pentanone in CO2 by the Taylor dispersion technique from 308.15 to 328.15 K in the pressure range from 8 to 35 MPa.
Funazukuri T, et al.
International Journal of Thermophysics, 21(6), 1279-1290 (2000)
Phase liquid-vapor equilibria and thermodynamic properties of solutions of n-propanol-aliphatic ketones.
Suntsov YK, et al.
Russian Journal of Physical Chemistry A, 89(6), 926-930 (2015)
Atmospheric chemistry of 2-pentanone and 2-heptanone.
Atkinson R, et al.
Environmental Science & Technology, 34(4), 623-631 (2000)
On the dissociation of the 2-pentanone ion studied by threshold photoelectron photoion coincidence spectroscopy.
Kercher JP, et al.
International Journal of Mass Spectrometry, 249, 403-411 (2006)
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