Registration Dossier
Registration Dossier
Please be aware that this old REACH registration data factsheet is no longer maintained; it remains frozen as of 19th May 2023.
The new ECHA CHEM database has been released by ECHA, and it now contains all REACH registration data. There are more details on the transition of ECHA's published data to ECHA CHEM here.
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EC number: - | CAS number: -
Partition coefficient
Administrative data
Link to relevant study record(s)
- Endpoint:
- partition coefficient
- Type of information:
- read-across based on grouping of substances (category approach)
- Adequacy of study:
- supporting study
- Reliability:
- 2 (reliable with restrictions)
- Rationale for reliability incl. deficiencies:
- other: Data are being assessed for the use in a category approach. Available information are being judged as reliable with restrictions since it was conducted by a modeled and measured data.
- Remarks:
- Data are being assessed for the use in a category approach. Available information are being judged as reliable with restrictions since it was conducted by a modeled and measured data.
- Justification for type of information:
- Modeled and measured data
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. - Qualifier:
- no guideline available
- GLP compliance:
- no
- Key result
- Type:
- log Pow
- Partition coefficient:
- ca. 3
- Conclusions:
- The partition coefficient is:
- C18 4.13
- C18:1 3.92
- C18:2 3.70 (modeled) - Executive summary:
The partition coefficient is > 3.
- Endpoint:
- partition coefficient
- Type of information:
- (Q)SAR
- Adequacy of study:
- weight of evidence
- Study period:
- 2018
- 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
- GLP compliance:
- no
- Key result
- Type:
- log Pow
- Partition coefficient:
- ca. 6.2
- Remarks on result:
- other: Qsar Prediction
- Remarks:
- Qsar Prediction
- Conclusions:
- The partition coefficient is 6.2.
- Executive summary:
The partition coefficient is 6.2.
- Endpoint:
- partition coefficient
- 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
- Remarks on result:
- not measured/tested
- Conclusions:
- Overall, considering available data on the category members the partition coefficient of the substance is > 3.
- Executive summary:
The partition coefficient of the substance is > 3.
Referenceopen allclose all
Description of key information
A collection of the partition coefficients was performed.
The partition coefficient of the substance is > 3.
Key value for chemical safety assessment
- Log Kow (Log Pow):
- 4
Additional information
Overall, considering available data on the category members the partition coefficient of the substance is > 3.
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.
