Registration Dossier

Administrative data

Endpoint:
Henry's law constant
Type of information:
calculation (if not (Q)SAR)
Remarks:
Migrated phrase: estimated by calculation
Adequacy of study:
key study
Reliability:
2 (reliable with restrictions)
Rationale for reliability incl. deficiencies:
other: Scientifically acceptable method.

Data source

Reference
Reference Type:
other: EPIWin calculation
Title:
Unnamed
Year:
2010
Report date:
2010

Materials and methods

Principles of method if other than guideline:
Calculation using SRC HENRYWIN v3.20.
GLP compliance:
no

Test material

Constituent 1
Chemical structure
Reference substance name:
Disodium 4,4'-bis[(4-anilino-6-morpholino-1,3,5-triazin-2-yl)amino]stilbene-2,2'-disulphonate
EC Number:
240-245-2
EC Name:
Disodium 4,4'-bis[(4-anilino-6-morpholino-1,3,5-triazin-2-yl)amino]stilbene-2,2'-disulphonate
Cas Number:
16090-02-1
Molecular formula:
C40H38N12Na2O8S2
IUPAC Name:
disodium 5-{[4-(morpholin-4-yl)-6-(phenylamino)-1,3,5-triazin-2-yl]amino}-2-[(E)-2-(4-{[4-(morpholin-4-yl)-6-(phenylamino)-1,3,5-triazin-2-yl]amino}-2-sulfonatophenyl)ethenyl]benzene-1-sulfonate
Test material form:
solid

Results and discussion

Henry's Law constant H
H:
0 Pa m³/mol
Temp.:
25 °C
Remarks on result:
other: No difference occurs in the estimated results using the acid form or the bound [Na] form.

Applicant's summary and conclusion

Conclusions:
Henry's Law Constant: 0 Pa m³/mol at 25 °C
Executive summary:

Method

The Henry's Law Constant was calculated using the SRC HENRYWIN v3.20. Henrywin is an application contained in the EpiSuite 4.1, the suite of physical/chemical property and environmental fate estimation programs developed by the EPA’s Office of Pollution Prevention Toxics and Syracuse Research Corporation (SRC).

Results

Henry's Law Constant: 0 Pa m³/mol at 25 °C