Registration Dossier
Registration Dossier
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EC number: 500-268-3 | CAS number: 87041-44-9
Water solubility
Administrative data
Link to relevant study record(s)
- Endpoint:
- water solubility
- Type of information:
- (Q)SAR
- Adequacy of study:
- key study
- Reliability:
- 2 (reliable with restrictions)
- Rationale for reliability incl. deficiencies:
- results derived from a valid (Q)SAR model and falling into its applicability domain, with adequate and reliable documentation / justification
- Qualifier:
- no guideline followed
- Principles of method if other than guideline:
- QSAR model using EPI Suite model was applied.
- Water solubility:
- 0.045 µg/L
- Conc. based on:
- test mat.
- Temp.:
- 25 °C
- pH:
- 7
- Conclusions:
- Solubility of 1-[(2-aminocyclohexyl)amino]-3-(4-{2-[4-(3-{4-[2-(4-{3-[(2-aminocyclohexyl)amino]-2-hydroxypropoxy}phenyl)propan-2-yl]phenoxy}-2-hydroxypropoxy)phenyl]propan-2-yl}phenoxy)propan-2-ol was estimated to be 0.045 mcg/l (25 C) using EPI Suite tool.
- Executive summary:
Solubility of 1-[(2-aminocyclohexyl)amino]-3-(4-{2-[4-(3-{4-[2-(4-{3-[(2-aminocyclohexyl)amino]-2-hydroxypropoxy}phenyl)propan-2-yl]phenoxy}-2-hydroxypropoxy)phenyl]propan-2-yl}phenoxy)propan-2-ol was estimated to be 0.045 mcg/l (25 C) using EPI Suite tool.
Reference
Description of key information
Water solubility for components of the registered material was determined using EPI suite model. highest solubility is reported in summary section.
Key value for chemical safety assessment
- Water solubility:
- 2.69 mg/L
- at the temperature of:
- 25 °C
Additional information
Information on Registered Substances comes from registration dossiers which have been assigned a registration number. The assignment of a registration number does however not guarantee that the information in the dossier is correct or that the dossier is compliant with Regulation (EC) No 1907/2006 (the REACH Regulation). This information has not been reviewed or verified by the Agency or any other authority. The content is subject to change without prior notice.
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