3,6,9,12-Tetraoxatetradeca-1,13-diene

Henry's Law constant

Administrative data

Endpoint:

Henry's law constant

Type of information:

calculation (if not (Q)SAR)

Remarks:

Migrated phrase: estimated by calculation

Adequacy of study:

other information

Reliability:

2 (reliable with restrictions)

Rationale for reliability incl. deficiencies:

other: Scientifically acceptable method

Data source

Reference

Reference Type:

other: model calculation report

Title:

Unnamed

Year:

2011

Materials and methods

Test guideline

Qualifier:

no guideline required

Principles of method if other than guideline:

Calculation using SRC HENRYWIN v3.20

GLP compliance:

no

Test material

Test material information

Constituent 1

Results and discussion

Henry's Law constant H

H:

0 - 0.003 Pa m³/mol

Temp.:

25 °C

Remarks on result:

other: Henrys LC [via VP/WSol estimate using User-Entered or Estimated values]: VP: 0.00315 mm Hg (source: User-Entered) WS: 3.07E+004 mg/L (source: User-Entered)

Any other information on results incl. tables

The data refer to the uncharged molecule (calculated pKa value: 10.03)

6.08E-036 Pa-m3/mole