3-Methyl-3-pentanol

3-Methyl-3-pentanol Structure
3-Methyl-3-pentanol structure
Common Name 3-Methyl-3-pentanol
CAS Number 77-74-7 Molecular Weight 102.175
Density 0.8±0.1 g/cm3 Boiling Point 122.4±0.0 °C at 760 mmHg
Molecular Formula C6H14O Melting Point -24ºC
MSDS Chinese USA Flash Point 46.1±0.0 °C
Symbol GHS02 GHS07
GHS02, GHS07
Signal Word Warning

Convenient QSAR model for predicting the complexation of structurally diverse compounds with β-cyclodextrins

Bioorg. Med. Chem. 17 , 896-904, (2009)

This paper reports a QSAR study for predicting the complexation of a large and heterogeneous variety of substances (233 organic compounds) with beta-cyclodextrins (beta-CDs). Several different theoretical molecular descriptors, calculated solely from the mole...