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Density

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Endpoint:
relative density
Type of information:
(Q)SAR
Adequacy of study:
weight of evidence
Reliability:
2 (reliable with restrictions)
Rationale for reliability incl. deficiencies:
results derived from a (Q)SAR model, with limited documentation / justification, but validity of model and reliability of prediction considered adequate based on a generally acknowledged source
Justification for type of information:
QSAR prediction

1. SOFTWARE
Danish (Q)SAR Database

2. MODEL
http://qsardb.food.dtu.dk/db/index.html

3. SMILES OR OTHER IDENTIFIERS USED AS INPUT FOR THE MODEL
C(=O)(O)C(CCC(=O)O)NC(=O)CCCCCCCC=CCCCCCCCC

4. SCIENTIFIC VALIDITY OF THE (Q)SAR MODEL
http://qsardb.food.dtu.dk/db/index.html

5. APPLICABILITY DOMAIN
http://qsardb.food.dtu.dk/Danish_QSAR_Database_Draft_User_manual.pdf

6. ADEQUACY OF THE RESULT
Prediction fits the purpose of REACH Regulation.
Guideline:
other: REACH guidance on QSARs R6, May 2008
Principles of method if other than guideline:
Density prediction
GLP compliance:
no
Key result
Type:
relative density
Remarks:
QSAR prediction
Density:
ca. 1.06 g/cm³
Remarks on result:
other: QSAR prediction
Remarks:
QSAR prediction
Conclusions:
Predicted density is 1,06 g/cm³.
Executive summary:

Density is 1,06 g/cm³.

Endpoint:
relative density
Type of information:
read-across based on grouping of substances (category approach)
Adequacy of study:
weight of evidence
Justification for type of information:
Important considerations for the read-across were:

Sodium Olivoyl Glutamate (the target chemical) has similar physico-chemical properties as the others members:
- "Aliphatic acid category" (the source chemicals);
- "Amino acid alkyl amides category" (the source chemicals);
- Sodium oleoyl glutamate (the source chemicals);

Key points are that the members share:
- the same structural features
- similar metabolic pathways
- common levels and mode of human health related effects
- function.
Key result
Type:
relative density
Remarks on result:
not measured/tested
Conclusions:
Overall, considering available data on the category members, density is 1,06 g/cm³.
Executive summary:

Density is 1,06 g/cm³.

Description of key information

Key value for chemical safety assessment

Relative density at 20C:
1

Additional information

Overall, considering available data on the category members, density is 1 g/cm³.