10967/172 - QDB Compounds

QsarDB Repository

Papa, E.; Gramatica, P. Externally validated QSPR modelling of VOC tropospheric oxidation by NO3 radicals. SAR QSAR Environ. Res. 2008, 19, 655–668.

Compound

ID:45
Name:Styrene
Description:
Labels:aromatics
CAS:100-42-5
InChi Code:InChI=1S/C8H8/c1-2-8-6-4-3-5-7-8/h2-7H,1H2

Properties

pkNO3: Degradation by NO3 radicals as -logkNO3 [log(s molecule/cm3)] i

ValueSource or prediction
11.82

experimental value

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