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:	168
	Name:	Isopropyl formate
	Description:
	Labels:	Testing
	CAS:	625-55-8
	InChi Code:	InChI=1S/C4H8O2/c1-4(2)6-3-5/h3-4H,1-2H3

Properties

Tb: Boiling point [°C]

Value	Source or prediction
67.2	experimental value
73.5	Tab7_Tb: RBF-NN model for diverse chemicals (Testing set)

Tf: Flash point [°C]

Value	Source or prediction
-6	experimental value
-0.4	Tab7_Tf: RBF-NN model for diverse chemicals (Testing set)

Links to External Resources

Link	Resource description
DTXSID2027258	US EPA CompTox Dashboard