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:54597-66-9
Name:Butane
Description:
Labels:
CAS:54597-66-9
InChi Code:InChI=1S/C4H10/c1-3-4-2/h3-4H2,1-2H3

Properties

Tb: Normal boiling point [K]

ValueSource or prediction
272.65

experimental value

265.17

Eq12: Model for normal boiling point (Training set)

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

ValueSource or prediction
385.8

experimental value

379.41

Eq13: Model for enthalphy of vaporization (Training set)