Registration Dossier
Registration Dossier
Use of this information is subject to copyright laws and may require the permission of the owner of the information, as described in the ECHA Legal Notice.
EC number: 226-375-2 | CAS number: 5382-23-0
Water solubility
Administrative data
Link to relevant study record(s)
- Endpoint:
- water solubility
- Type of information:
- calculation (if not (Q)SAR)
- Adequacy of study:
- key study
- Reliability:
- 2 (reliable with restrictions)
- Rationale for reliability incl. deficiencies:
- accepted calculation method
- Justification for type of information:
- data is from modelling database
- Qualifier:
- equivalent or similar to guideline
- Guideline:
- other: estimated data
- Principles of method if other than guideline:
- WSKOW v1.42 was used to estimate the water solubility of test substance 4-chloro-1-methylpiperidinium chloride
- GLP compliance:
- not specified
- Type of method:
- other: estimated data
- Specific details on test material used for the study:
- - Name of test material: 4-chloro-1-methylpiperidinium chloride
- IUPAC name: 4-chloro-1-methylpiperidin-1-ium chloride
- Molecular formula: C6H13Cl2N
- Molecular weight: 170.0817 g/mole
- Smiles : CN1CCC(CC1)Cl.Cl
- Inchl: 1S/C6H12ClN.ClH/c1-8-4-2-6(7)3-5-8;/h6H,2-5H2,1H3;1H
- Substance type: Organic
- Physical state: Solid crystal powder (White - Slightly pale yellow) - Key result
- Water solubility:
- 15 380 mg/L
- Conc. based on:
- test mat.
- Temp.:
- 25 °C
- Remarks on result:
- other: no other details available
- Conclusions:
- The estimated water solubility of substance 4-chloro-1-methylpiperidinium chloride at 25 deg C was 15380 mg/l.
- Executive summary:
WSKOW v1.42 was used to estimate the water solubility of the substance 4-chloro-1-methylpiperidinium chloride.
The estimated water solubility of the substance 4-chloro-1-methylpiperidinium chloride at 25 deg C was 15380 mg/l.
Based on the estimated value, the substance 4-chloro-1-methylpiperidinium chloride was considered to be very soluble in water.
Reference
Description of key information
The estimated water solubility of test substance 4-chloro-1-methylpiperidinium chloride at 25 deg C was 15380 mg/l.
Key value for chemical safety assessment
- Water solubility:
- 15 380 mg/L
- at the temperature of:
- 25 °C
Additional information
WSKOW v1.42 was used to estimate the water solubility of the test substance 4-chloro-1-methylpiperidinium chloride.
The estimated water solubility of the test substance 4-chloro-1-methylpiperidinium chloride at 25 deg C was 15380 mg/l.
Based on the estimated value, the test substance 4-chloro-1-methylpiperidinium chloride was considered to be very soluble in water.
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.
Reproduction or further distribution of this information may be subject to copyright protection. Use of the information without obtaining the permission from the owner(s) of the respective information might violate the rights of the owner.
