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EC number: 218-191-6 | CAS number: 2068-80-6
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:
- 2019-09-06
- 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
EPISUITE v4.11 software
2. MODEL (incl. version number)
MPBPWIN v1.43 model
3. SMILES OR OTHER IDENTIFIERS USED AS INPUT FOR THE MODEL
SMILES: C(=O)(O)C(N)CC(=O)O
CAS: 56-84-8
4. SCIENTIFIC VALIDITY OF THE (Q)SAR MODEL
For a detailed justification please refer to the attached justification
5. APPLICABILITY DOMAIN
For a detailed justification please refer to the attached justification
6. ADEQUACY OF THE RESULT
For a detailed justification please refer to the attached justification - Qualifier:
- no guideline followed
- Principles of method if other than guideline:
- - Software tool(s) used including version:
EPISUITE v4.11 software
- Model(s) used:
MPBPWIN v1.43 model
- Model description: see field 'Attached justification'
- Justification of QSAR prediction: see field 'Attached justification' - GLP compliance:
- no
- Type of method:
- other: QSAR estimation
- Key result
- Test no.:
- #1
- Temp.:
- 25 °C
- Vapour pressure:
- 0 Pa
- Remarks on result:
- other: Result estimated with KOWWIN v1.68
- Conclusions:
- According to the performed QSAR prediction the vapour pressure of L-aspartic acid is 3.5E-05 Pa at 25°C. The contained magnesium ion is not considered to rise the vapour pressure.
- Executive summary:
According to the performed QSAR prediction the vapour pressure of L-aspartic acid is 3.5E-05 Pa at 25°C. The contained magnesium ion is not considered to rise the vapour pressure.
Reference
Description of key information
According to the performed QSAR prediction the vapour pressure of L-aspartic acid is 3.5E-05 Pa at 25°C.
Key value for chemical safety assessment
- Vapour pressure:
- 0 Pa
- at the temperature of:
- 25 °C
Additional information
The vapour pressure for L-aspartic acid was determined using Estimation Programs Interface Suite™ for Microsoft® Windows v4.11. US EPA, MPBPWIN v1.43 model. The vapour pressure is 3.5E-05 Pa at 25 °C. The additionally contained magnesium ion in the test item is not considered to elevate the vapour pressure due to the ionic structure. This assumption is substantiated by the measured decomposition temperature, indicating no boiling/evaporation up to decomposition temperature.
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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