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EC number: 230-237-7 | CAS number: 6976-37-0
Vapour pressure
Administrative data
Link to relevant study record(s)
- Endpoint:
- vapour pressure
- Type of information:
- (Q)SAR
- Adequacy of study:
- key study
- Study period:
- from November 2015 to May 2016
- 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
- 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: C(CO)N(CCO)C(CO)(CO)CO
4. SCIENTIFIC VALIDITY OF THE (Q)SAR MODEL: not required (MPBPWIN is considered a recognised calculation method as required in the REACH Regulation, Annex VII, 7.4, column 2)
5. APPLICABILITY DOMAIN: not required (MPBPWIN is considered a recognised calculation method as required in the REACH Regulation, Annex VII, 7.4, column 2)
6. ADEQUACY OF THE RESULT: not applicable (endpoint is not relevant for classification and labelling and risk assessment) - Qualifier:
- according to guideline
- Guideline:
- other: REACH guidance on QSAR R.6
- Principles of method if other than guideline:
- The boiling point was estimated by an atom/fragment contribution method using the software MPBPWIN Version v1.43 using the SMILES C(CO)N(CCO)C(CO)(CO)CO.
- GLP compliance:
- yes
- Type of method:
- other: MPBPWIN v1.43
- Specific details on test material used for the study:
- SMILES C(CO)N(CCO)C(CO)(CO)CO
- Key result
- Temp.:
- 25 °C
- Vapour pressure:
- 0 Pa
- Conclusions:
- Using MPBPWIN v1.43 the vapour pressure of the test item was calculated to be 0.0000000813 Pa at 25 °C.
- Executive summary:
The vapour pressure was calculated using MPBPWIN v1.43 as part of EPISuite v4.11 from US Environmental Protection Agency. Using MPBPWIN v1.43 the vapour pressure of the test item was calculated to be 0.0000000813 Pa at 25 °C.
Reference
The vapour pressure of the substance was determined with a recognised calculation method (MPBPWIN v1.43).
It was estimated to be 0.0000000813 Pa at 25 °C.
Description of key information
Using MPBPWIN v1.43 the vapour pressure of the test item was calculated to be 0.0000000813 Pa at 25 °C (reference 4.6-1).
Key value for chemical safety assessment
- Vapour pressure:
- 0 Pa
- at the temperature of:
- 25 °C
Additional information
The vapour pressure was calculated using MPBPWIN v1.43 as part of EPISuite v4.11 from US Environmental Protection Agency. Using MPBPWIN v1.43 the vapour pressure of the test item was calculated to be 0.0000000813 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.
