Tetteh, J.; Suzuki, T.; Metcalfe, E.; Howells, S. Quantitative Structure-Property Relationships for the Estimation of Boiling Point and Flash Point Using a Radial Basis Function Neural Network. J. Chem. Inf. Model. 1999, 39, 491-507.

Compound

	ID:	19
	Name:	Nonane
	Description:
	Labels:	Training
	CAS:	111-84-2
	InChi Code:	InChI=1S/C9H20/c1-3-5-7-9-8-6-4-2/h3-9H2,1-2H3

Properties

Tb: Boiling point [°C]

Value	Source or prediction
150.8	experimental value
144.5	Tab7_Tb: RBF-NN model for diverse chemicals (Training set)

Tf: Flash point [°C]

Value	Source or prediction
31	experimental value
29.9	Tab7_Tf: RBF-NN model for diverse chemicals (Training set)

Links to External Resources

Link	Resource description
DTXSID9025796	US EPA CompTox Dashboard