Registration Dossier

Administrative data

Endpoint:
phototransformation in air
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 calculation.

Data source

Reference
Reference Type:
other: EPIWIN calculation
Title:
Unnamed
Year:
2011
Report date:
2011

Materials and methods

Principles of method if other than guideline:
calculated using SRC AOP v1.92
GLP compliance:
no

Test material

Constituent 1
Chemical structure
Reference substance name:
2,9-bis(2-phenylethyl)anthra[2,1,9-def:6,5,10-d'e'f']diisoquinoline-1,3,8,10(2H,9H)-tetrone
EC Number:
266-564-7
EC Name:
2,9-bis(2-phenylethyl)anthra[2,1,9-def:6,5,10-d'e'f']diisoquinoline-1,3,8,10(2H,9H)-tetrone
Cas Number:
67075-37-0
Molecular formula:
C40H26N2O4
IUPAC Name:
7,18-bis(2-phenylethyl)-7,18-diazaheptacyclo[14.6.2.2²,⁵.0³,¹².0⁴,⁹.0¹³,²³.0²⁰,²⁴]hexacosa-1(22),2,4,9,11,13(23),14,16(24),20,25-decaene-6,8,17,19-tetrone

Study design

Estimation method (if used):
PHOTOCHEMICAL REACTION WITH OH RADICALS
- Concentration of OH radicals: 1.5E6 OH/cm3
- Degradation rate constant: 0.0000000000588 cm³/molecule-sec
- Temperature for which rate constant was calculated: 25 °C
- Calculated t 1/2 is based on a 12 h day

Results and discussion

Dissipation half-life of parent compound
DT50:
2.2 h

Applicant's summary and conclusion