Gramatica, P.; Cassani, S.; Chirico, N. QSARINS-chem: Insubria datasets and new QSAR/QSPR models for environmental pollutants in QSARINS. J. Comput. Chem. 2014, 35, 1036–1044.

Compound

	ID:	723
	Name:	ethyl 2-phenylacetate
	Description:	IUPAC names and InChI codes were generated with InstantJChem Original name was: Ethyl Phenylacetate
	Labels:
	CAS:	101-97-3
	InChi Code:	InChI=1S/C10H12O2/c1-2-12-10(11)8-9-6-4-3-5-7-9/h3-7H,2,8H2,1H3

Properties

M2.logKoc: Soil sorption coefficient as log(Koc) i

Value	Source or prediction
1.89	experimental value
1.9672	Tab2.Model_2: logKoc (Training set)

Links to External Resources

Link	Resource description
DTXSID6044353	US EPA CompTox Dashboard