Registration Dossier
Registration Dossier
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EC number: 213-313-4 | CAS number: 936-49-2
Additional ecotoxological information
Administrative data
- Endpoint:
- additional ecotoxicological information
- Type of information:
- (Q)SAR
- Adequacy of study:
- supporting study
- Reliability:
- 2 (reliable with restrictions)
- Justification for type of information:
- QSAR prediction: migrated from IUCLID 5.6
Data source
Reference
- Title:
- Unnamed
- Year:
- 2 010
Materials and methods
Test guideline
- Guideline:
- other: QSAR
- GLP compliance:
- not specified
Test material
- Reference substance name:
- 2-phenyl-2-imidazoline
- EC Number:
- 213-313-4
- EC Name:
- 2-phenyl-2-imidazoline
- Cas Number:
- 936-49-2
- Molecular formula:
- C9H10N2
- IUPAC Name:
- 2-phenyl-4,5-dihydro-1H-imidazole
Constituent 1
Results and discussion
Any other information on results incl. tables
--------------------------- KOCWIN v2.00 Results ---------------------------
Koc Estimate from MCI:
---------------------
First Order Molecular Connectivity Index ........... : 5.466
Non-Corrected Log Koc (0.5213 MCI + 0.60) .......... : 3.4494
Fragment Correction(s):
2 Nitrogen to Carbon (aliphatic) (-N-C).. : -0.4255
Corrected Log Koc .................................. : 3.0239
Estimated Koc: 1057 L/kg <===========
Koc Estimate from Log Kow:
-------------------------
Log Kow (Kowwin estimate) ......................... : 2.45
Non-Corrected Log Koc (0.55313 logKow + 0.9251) .... : 2.2803
Fragment Correction(s):
2 Nitrogen to Carbon (aliphatic) (-N-C).. : -0.0436
Corrected Log Koc .................................. : 2.2367
Estimated Koc: 172.5 L/kg <===========
Applicant's summary and conclusion
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