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:464-06-2
Name:2,2,3-Trimethylbutane
Description:
Labels:
CAS:464-06-2
InChi Code:InChI=1S/C7H16/c1-6(2)7(3,4)5/h6H,1-5H3

Properties

Tb: Normal boiling point [K]

ValueSource or prediction
354.01

experimental value

349.79

Eq12: Model for normal boiling point (Training set)

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

ValueSource or prediction
288.337

experimental value

289.6

Eq13: Model for enthalphy of vaporization (Training set)

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