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Please be aware that this old REACH registration data factsheet is no longer maintained; it remains frozen as of 19th May 2023.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: 275-203-2 | CAS number: 71119-23-8
Vapour pressure
Administrative data
Link to relevant study record(s)
- Endpoint:
- vapour pressure
- 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
- Justification for type of information:
- 1. SOFTWARE: Epi Suite
2. MODEL (incl. version number): MPBPWIn v1.43
3. SMILES OR OTHER IDENTIFIERS USED AS INPUT FOR THE MODEL: C1COCCN1CCS(=O)(=O)O([Na])
4. SCIENTIFIC VALIDITY OF THE (Q)SAR MODEL: not required (as the study does not need to be conducted for substances that decompose < 300 °C)
5. APPLICABILITY DOMAIN: not required (as the study does not need to be conducted for substances that decompose < 300 °C)
6. ADEQUACY OF THE RESULT: not applicable (endpoint is not relevant for classification and labelling and risk assessment) - Qualifier:
- according to guideline
- Guideline:
- other: ECHA Guidance on information requirements and chemical safety assessment Chapter R.6: QSARs and grouping of chemicals
- Version / remarks:
- May 2008
- Deviations:
- no
- Principles of method if other than guideline:
- The vapour pressure was estimated by an atom/fragment contribution method using the software MPBPWIN v1.43 using the SMILES C1COCCN1CCS(=O)(=O)O([Na]).
- GLP compliance:
- yes
- Type of method:
- other: QSAR calculation method
- Remarks:
- As the substance decomposes before melting, the vapour pressure cannot be determined experimentally. Therefore, it was calculated.
- Specific details on test material used for the study:
- SMILES: C1COCCN1CCS(=O)(=O)O([Na])
- Key result
- Temp.:
- 25 °C
- Vapour pressure:
- 0 Pa
- Remarks on result:
- other: QSAR predicted value
- Conclusions:
- The vapour pressure of the test item was calculated to 1.63e-9 Pa at 25 °C.
- Executive summary:
As the substance decomposes before melting, the vapour pressure could not be determined experimentally. Therefore, the vapour pressure was calculated using MPBPWIN Version v1.43. The vapour pressure of the test item was estimated to 1.63e-9 Pa at 25 °C.
Reference
Description of key information
The vapour pressure of the test item was calculated to 1.63e-9 Pa at 25 °C.
Key value for chemical safety assessment
- Vapour pressure:
- 0 Pa
- at the temperature of:
- 25 °C
Additional information
As the substance decomposes before melting, the vapour pressure could not be determined experimentally. Therefore, the vapour pressure was calculated using MPBPWIN Version v1.43. The vapour pressure of the test item was estimated to 1.63e-9 Pa at 25 °C.
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.
