Registration Dossier

Administrative data

Endpoint:
vapour pressure
Type of information:
(Q)SAR
Adequacy of study:
key study
Study period:
2019
Reliability:
2 (reliable with restrictions)
Justification for type of information:
1. SOFTWARE : Epiwin version 4.11

2. MODEL (incl. version number) : Modified Grain method

3. SMILES OR OTHER IDENTIFIERS USED AS INPUT FOR THE MODEL : CCCCCCCCCCCCCCOC(CCCCCCCCCCCCC)=O

4. SCIENTIFIC VALIDITY OF THE (Q)SAR MODEL
[Explain how the model fulfils the OECD principles for (Q)SAR model validation. Consider attaching the QMRF or providing a link]
- Defined endpoint: Vapour pressure
-- Defined domain of applicability: esters


6. ADEQUACY OF THE RESULT
[Explain how the prediction fits the purpose of classification and labelling and/or risk assessment]

Data source

Reference
Reference Type:
other company data
Title:
Unnamed
Year:
2019
Report Date:
2019

Materials and methods

Principles of method if other than guideline:
- Software tool(s) used including version: Epiwin Version 4.11
- Model(s) used: Modified Grain method

Test material

Reference
Name:
Unnamed
Type:
Constituent
Test material form:
solid: flakes

Results and discussion

Vapour pressure
Key result
Temp.:
ca. 25 °C
Vapour pressure:
ca. 18.5 Pa
Remarks on result:
other: QSAR

Applicant's summary and conclusion