UNII:N603804P52

UNII:N603804P52 Structure
UNII:N603804P52 structure
Common Name UNII:N603804P52
CAS Number 1757-42-2 Molecular Weight 98.143
Density 0.9±0.1 g/cm3 Boiling Point 141.6±8.0 °C at 760 mmHg
Molecular Formula C6H10O Melting Point N/A
MSDS Chinese USA Flash Point 36.7±0.0 °C
Symbol GHS02
GHS02
Signal Word Warning

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, with a full account of Franck-Condon and Herzberg-Teller v...

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 explore the role of ring size/morphology and to elucidate th...