10967/128 - QDB Compounds

QsarDB Repository

Abooali, D.; Sobati, M. A. Novel method for prediction of normal boiling point and enthalpy of vaporization at normal boiling point of pure refrigerants: A QSPR approach. Int. J. Refrig. 2014, 40, 282–293.

Compound

ID:74-87-3
Name:Chloromethane
Description:
Labels:
CAS:74-87-3
InChi Code:InChI=1S/CH3Cl/c1-2/h1H3

Properties

Tb: Normal boiling point [K]

ValueSource or prediction
248.95

experimental value

281.81

Eq12: Model for normal boiling point (Training set)

Hvb: Enthalphy of vaporization at normal boiling point [kJ/kg]

ValueSource or prediction
428.7

experimental value

443.96

Eq13: Model for enthalphy of vaporization (Validation set)

Links to External Resources