10967/128 - QDB Compounds

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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:95-49-8
Name:1-Chloro-2-methylbenzene
Description:
Labels:
CAS:95-49-8
InChi Code:InChI=1S/C7H7Cl/c1-6-4-2-3-5-7(6)8/h2-5H,1H3

Properties

Tb: Normal boiling point [K]

ValueSource or prediction
432.15

experimental value

458.36

Eq12: Model for normal boiling point (Training set)

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

ValueSource or prediction
296.23

experimental value

282.89

Eq13: Model for enthalphy of vaporization (Training set)

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