Registration Dossier
Registration Dossier
Please be aware that this old REACH registration data factsheet is no longer maintained; it remains frozen as of 19th May 2023.
The new ECHA CHEM database has been released by ECHA, and it now contains all REACH registration data. There are more details on the transition of ECHA's published data to ECHA CHEM here.
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: 218-617-0 | CAS number: 2206-27-1
Partition coefficient
Administrative data
- Endpoint:
- partition coefficient
- Type of information:
- calculation (if not (Q)SAR)
- Adequacy of study:
- key study
- Study period:
- 2019
- 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 limited documentation / justification
Data source
Reference
- Reference Type:
- other: Online calculator
- Title:
- Unnamed
- Year:
- 2 019
- Report date:
- 2019
Materials and methods
Test guideline
- Qualifier:
- no guideline followed
- Principles of method if other than guideline:
- Online MOLINSPIRATION software
- GLP compliance:
- no
- Type of method:
- calculation method (fragments)
- Partition coefficient type:
- octanol-water
Test material
- Reference substance name:
- Di[(2H3)methyl] sulphoxide
- EC Number:
- 218-617-0
- EC Name:
- Di[(2H3)methyl] sulphoxide
- Cas Number:
- 2206-27-1
- Molecular formula:
- C2D6OS
- IUPAC Name:
- dimethyl sulfoxide
Constituent 1
Results and discussion
Partition coefficient
- Key result
- Type:
- log Pow
- Partition coefficient:
- ca. -0.69
- Temp.:
- 20 °C
- pH:
- ca. 7
- Details on results:
- Temperature and pH not specified
Applicant's summary and conclusion
- Conclusions:
- The partition coefficient was calculated with Molinspiration software: miLogP is equal to -0.69
- Executive summary:
As experimental study cannot be performed because the substance DMSO-d6 has a high surface activity, the partition coefficient was calculated with Molinspiration software: miLogP is equal to -0.69
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.
