UNII:N603804P52

Names

[ Name ]:
UNII:N603804P52

[Synonym ]:
3-Methylcyclopentanone
DL-3-Methylcyclopentanone
3-Methyl-1-cyclopentanone
MFCD00001416
UNII:N603804P52
EINECS 217-148-9
Cyclopentanone, 3-methyl-

Chemical & Physical Properties

[ Density]:
0.9±0.1 g/cm3

[ Boiling Point ]:
141.6±8.0 °C at 760 mmHg

[ Molecular Formula ]:
C₆H₁₀O

[ Molecular Weight ]:
98.143

[ Flash Point ]:
36.7±0.0 °C

[ Exact Mass ]:
98.073166

[ PSA ]:
17.07000

[ LogP ]:
0.69

[ Vapour Pressure ]:
5.8±0.3 mmHg at 25°C

[ Index of Refraction ]:
1.443

[ Storage condition ]:
Flammables area

[ Water Solubility ]:
soluble

MSDS

Safety Information

[ Symbol ]:

GHS02

[ Signal Word ]:
Warning

[ Hazard Statements ]:
H226

[ Personal Protective Equipment ]:
Eyeshields;Faceshields;full-face respirator (US);Gloves;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter

[ Hazard Codes ]:
F+

[ Risk Phrases ]:
R10

[ Safety Phrases ]:
S16

[ RIDADR ]:
UN 1224 3/PG 3

[ WGK Germany ]:
3

[ Packaging Group ]:
III

[ Hazard Class ]:
3

[ HS Code ]:
2914299000

Synthetic Route

Click to get detail synthetic route

Customs

[ HS Code ]: 2914299000

[ Summary ]:
2914299000. other cyclanic, cyclenic or cyclotherpenic ketones without other oxygen function. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:5.5%. General tariff:30.0%

Articles

Vibronically resolved electronic circular dichroism spectra of (R)-(+)-3-methylcyclopentanone: a theoretical study.

J. Phys. Chem. A 112(48) , 12401-11, (2008)

The vibrationally resolved electronic circular dichroism (ECD) spectra of the two dominant conformers of (R)-(+)-3-methylcyclopentanone in gas phase are computed by density functional response theory,...

Intrinsic optical activity and conformational flexibility: the role of size-dependent ring morphology in model cycloketones.

J. Phys. Chem. A 117(47) , 12382-400, (2013)

The optical rotatory dispersion of two monocyclic ketones, (R)-3-methylcyclopentanone [R-3MCP] and (R)-3-methylcyclohexanone [R-3MCH], has been investigated under isolated and solvated conditions to e...