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:107-39-1
Name:2,4,4-Trimethyl-1-Pentene
Description:
Labels:
CAS:107-39-1
InChi Code:InChI=1S/C8H16/c1-7(2)6-8(3,4)5/h1,6H2,2-5H3

Properties

Tb: Normal boiling point [K]

ValueSource or prediction
374.55

experimental value

378.13

Eq12: Model for normal boiling point (Training set)

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

ValueSource or prediction
276.06

experimental value

306.03

Eq13: Model for enthalphy of vaporization (Training set)

Links to External Resources