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:	223
	Name:	1,3-Dimethylbutylamine
	Description:
	Labels:	Training
	CAS:	108-09-8
	InChi Code:	InChI=1S/C6H15N/c1-5(2)4-6(3)7/h5-6H,4,7H2,1-3H3

Properties

Tb: Boiling point [°C]

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

Tf: Flash point [°C]

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

Links to External Resources

Link	Resource description
DTXSID4025113	US EPA CompTox Dashboard