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Administrative data

Endpoint:
Henry's law constant
Type of information:
(Q)SAR
Remarks:
Migrated phrase: estimated by calculation
Adequacy of study:
key study
Reliability:
2 (reliable with restrictions)
Rationale for reliability incl. deficiencies:
other: Estimated using software recommended by REACH guidance.

Data source

Reference
Reference Type:
other: software program
Title:
EPI v3.20. (February 2007. Estimation Programs Interface. U.S. Environmental Protection Agency Office of Pollution Prevention and Toxic Substances. Syracuse Research Corporation).
Author:
anonymous
Year:
2007
Bibliographic source:
U.S. Environmental Protection Agency, Washington, D.C.

Materials and methods

Principles of method if other than guideline:
Estimated, based on the chemical structure, using EPI v3.20. (February 2007. Estimation Programs Interface. U.S. Environmental Protection Agency Office of Pollution Prevention and Toxic Substances. Syracuse Research Corporation).
GLP compliance:
no

Test material

Constituent 1
Chemical structure
Reference substance name:
1,1'-(ethane-1,2-diyl)bis[pentabromobenzene]
EC Number:
284-366-9
EC Name:
1,1'-(ethane-1,2-diyl)bis[pentabromobenzene]
Cas Number:
84852-53-9
Molecular formula:
C14H4Br10
IUPAC Name:
1,2,3,4,5-pentabromo-6-[2-(2,3,4,5,6-pentabromophenyl)ethyl]benzene
Test material form:
solid

Results and discussion

Henry's Law constant Hopen allclose all
H:
0 atm m³/mol
Temp.:
25 °C
Atm. press.:
760 mm Hg
H:
0 dimensionless
Temp.:
25 °C
Atm. press.:
760 mm Hg

Any other information on results incl. tables

Henry's Law Constant (25˚C and normal atmospheric pressure) is estimated to be 6.42 x 10 -8(Bond method) and 2.94 x 10-8 (Group method) atm-m3/mole.

Applicant's summary and conclusion

Conclusions:
Henry's Law Constant (25˚C and normal atmospheric pressure) is estimated to be 6.42 x 10 -8 (Bond method) and 2.94 x 10-8 (Group method) atm-m3/mole.
Executive summary:

DBDPEthane's estimated Henry's Law Constant at 25˚C and normal atmospheric pressure is 6.42 x 10-8 (Bond method) and 2.94 x 10-8 (Group method) atm-m3/mole.