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:592-76-7
Name:1-Heptene
Description:
Labels:
CAS:592-76-7
InChi Code:InChI=1S/C7H14/c1-3-5-7-6-4-2/h3H,1,4-7H2,2H3

Properties

Tb: Normal boiling point [K]

ValueSource or prediction
366.79

experimental value

365.78

Eq12: Model for normal boiling point (Training set)

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

ValueSource or prediction
323.175

experimental value

318.13

Eq13: Model for enthalphy of vaporization (Training set)

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