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EC number: 807-130-4
CAS number: 53716-82-8
Henry's Law Constant:
Calculated HLC for Cyrene™
at 25°C: 6.3E-03 Pa m3mol-1
Calculated HLC for Gem Diol at
25°C: 3.9E-07 Pa m3mol-1
transfer of a substance from the water phase to the gas phase can be
estimated by means of the Henry’s Law Constant (HLC). No measured value
for this parameter is available.
HLC can be estimated using the established Bond method from HENRYWIN v.
3.20 within the EPIWeb suite v4.11. This method derives the Henry's Law
Constant directly from the structure, as
the sum of the bond contribution values for each chemical bond in the
molecule. The bond contribution values were determined based on
least-square regression analysis of measured HLCs for organic compounds.
calculated HLC value for Cyrene™
and Gem Diol at 25°C is very low, 6.3E-03 Pa
3.9E-7 Pa m3mol-1 respectively (HenryWin v 3.20).
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