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EC number: 629-770-1 | CAS number: 57968-71-5
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:
- November 30th, 2015
- 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
iSafeRat® HA-QSAR toolbox
2. MODEL (incl. version number)
iSafeRat® HA-QSAR v 1.3 to predict Vapour Pressure
3. SMILES OR OTHER IDENTIFIERS USED AS INPUT FOR THE MODEL
see attached QPRF
4. SCIENTIFIC VALIDITY OF THE (Q)SAR MODEL
See attached QMRF
5. APPLICABILITY DOMAIN
See attached QPRF
6. ADEQUACY OF THE RESULT
See attached QPRF - Reason / purpose for cross-reference:
- reference to same study
- Reason / purpose for cross-reference:
- reference to other study
- Qualifier:
- equivalent or similar to guideline
- Guideline:
- OECD Guideline 104 (Vapour Pressure Curve)
- Version / remarks:
- QSAR
- Deviations:
- not applicable
- Principles of method if other than guideline:
- See attached QMRF and QPRF
- GLP compliance:
- no
- Type of method:
- other: QSAR
- Key result
- Temp.:
- 25 °C
- Vapour pressure:
- 0.402 Pa
- Remarks on result:
- other: 95% confidence limits (Pa) = 0.304 - 0.530
- Conclusions:
- Vapour pressure of DIETHYL TARTRATE is predicted to be 0.402 Pa at 25°C with a 95% confidence limits of 0.304 Pa to 0.530 Pa.
(Low volatility (based on volatility bands criteria for occupational exposure (Chesar / ECETOC TRA), << 500 Pa) - Executive summary:
Vapour pressure, VP, of the substance DIETHYL TARTRATE, has been calculated by the model iSafeRat® vapour pressure HA-QSAR v1.3. Calculation was performed from the input Boiling point of diethyl DL-tartrate, and DIETHYL TARTRATE falls inside the Applicability Domain of the model.
Therefore, the VP value of DIETHYL TARTRATE is predicted to be 0.402 Pa at 25°C with a 95% interval limits of 0.304 to 0.530 Pa.
Reference
Description of key information
The Vapour Pressure (Vp) of DIETHYL TARTRATE is predicted to be 0.402 Pa at 25°C with a 95% interval limits of 0.304 to 0.530 Pa (estimated by QSAR).
(Low volatility (based on volatility bands criteria for occupational exposure (Chesar / ECETOC TRA), << 500 Pa)
Key value for chemical safety assessment
- Vapour pressure:
- 0.402 Pa
- at the temperature of:
- 25 °C
Additional information
Vapour pressure, VP, of the substance DIETHYL TARTRATE, has been calculated by the model iSafeRat® HA-QSAR v1.3. Calculation was performed from the input Boiling point of diethyl DL-tartrate, and DIETHYL TARTRATE falls inside the Applicability Domain of the model.
Therefore, the VP value of DIETHYL TARTRATE is predicted to be 0.402 Pa at 25°C with a 95% interval limits of 0.304 to 0.530 Pa.
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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