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Environmental fate & pathways

Henry's Law constant

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Administrative data

Link to relevant study record(s)

Reference
Endpoint:
Henry's law constant
Type of information:
calculation (if not (Q)SAR)
Adequacy of study:
supporting study
Reliability:
2 (reliable with restrictions)
Rationale for reliability incl. deficiencies:
accepted calculation method
Qualifier:
no guideline followed
Principles of method if other than guideline:
The Henry's Law constant was calculated using the following equation:
Henry's Law constant = (Vapour pressure * Molecular weight)/Water solubility
GLP compliance:
no
Key result
H:
0.001 Pa m³/mol
Temp.:
20 °C
Atm. press.:
0 Pa
Remarks on result:
other: Unbuffered water
Key result
H:
0.001 Pa m³/mol
Temp.:
20 °C
Atm. press.:
0 Pa
Remarks on result:
other: pH 5
Key result
H:
0.001 Pa m³/mol
Temp.:
20 °C
Atm. press.:
0 Pa
Remarks on result:
other: pH 7
Key result
Temp.:
20 °C
Atm. press.:
0 Pa
Remarks on result:
other: pH 9
Remarks:
Not calculated due to rapid hydrolysis
Conclusions:
Henry's Law constant (Unbuffered water): 1.1E-3 Pa m³/mol
Henry's Law constant (pH 5): 1.4E-3 Pa m³/mol
Henry's Law constant (pH 7): 1.2E-3 Pa m³/mol
Henry's Law constant (pH 9): Not calculated due to rapid hydrolysis
Executive summary:

The Henry's Law constant is an indicator of the volatility of a solute from a dilute aqueous solution. The Henry's law constants for the test substance at 20 °C were calculated from previously measured values of vapor pressure and water solubility.

Henry's Law constant (Unbuffered water): 1.1E-3 Pa m ³/mol

Henry's Law constant (pH 5): 1.4E-3 Pa m ³/mol

Henry's Law constant (pH 7): 1.2E-3 Pa m ³/mol

Henry's Law constant (pH 9): Not calculated due to rapid hydrolysis

Description of key information

Key value for chemical safety assessment

Henry's law constant (H) (in Pa m³/mol):
0.001

Additional information