Registration Dossier
Registration Dossier
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EC number: 701-249-4 | CAS number: -
Basic toxicokinetics
Administrative data
- Endpoint:
- basic toxicokinetics, other
- Type of information:
- (Q)SAR
- Adequacy of study:
- supporting study
- Reliability:
- 2 (reliable with restrictions)
- Rationale for reliability incl. deficiencies:
- accepted calculation method
- Justification for type of information:
- QSAR modeling to predict the metabolism
Data source
Materials and methods
Test material
- Reference substance name:
- Phenol, paraalkylation products with C10-15 branched olefins ( C12 rich) derived from propene oligomerization, calcium salts, sulfurized, including distillates (petroleum), hydrotreated, solvent-refined, solvent-dewaxed, or catalyc dewaxed, light or heavy paraffinic C15-C50
- EC Number:
- 701-249-4
- Molecular formula:
- A molecular formula for this substance does not exist because it is a UVCB. The molecular formula for a theoretical representative structure is C36H58Ca2O4Sx where x = 1-3.
- IUPAC Name:
- Phenol, paraalkylation products with C10-15 branched olefins ( C12 rich) derived from propene oligomerization, calcium salts, sulfurized, including distillates (petroleum), hydrotreated, solvent-refined, solvent-dewaxed, or catalyc dewaxed, light or heavy paraffinic C15-C50
- Details on test material:
Phenol, dodecyl-, sulfurized, calcium salts
Testing was performed on a commercial sample of this material. Typical purity of this material as distributed in commerce is 60% alkyl phenol sulfide and 40% highly refined lubricant base oil.
Constituent 1
Results and discussion
Main ADME results
- Type:
- metabolism
- Results:
- The metabolism is predicted to occur based on known pathways, specifically, oxidation of the alkyl chain followed by phase II metabolism (e.g., glucuronidation)
Metabolite characterisation studies
- Metabolites identified:
- yes
- Details on metabolites:
- The metabolism is predicted to occur based on known pathways, specifically, oxidation of the alkyl chain followed by phase II metabolism (e.g., glucuronidation)
Applicant's summary and conclusion
- Executive summary:
The metabolism of the notified substances was evaluated using LMC OASIS TIMES (v2.28.1.4) in vitro rat liver simulator (v.11.15). The complete metabolism report (QPRF), with full details on the predicted metabolism, is attached. The metabolism is predicted to occur based on known pathways, specifically, oxidation of the alkyl chain followed by phase II metabolism (e.g., glucuronidation)
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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