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Please be aware that this old REACH registration data factsheet is no longer maintained; it remains frozen as of 19th May 2023.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.
Use of this information is subject to copyright laws and may require the permission of the owner of the information, as described in the ECHA Legal Notice.
EC number: 222-940-2 | CAS number: 3674-09-7
Genetic toxicity: in vitro
Administrative data
- Endpoint:
- genetic toxicity in vitro, other
- Remarks:
- VEGA QSAR
- Type of information:
- (Q)SAR
- Adequacy of study:
- other information
- 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
Data source
Reference
- Reference Type:
- other: VEGA report
- Title:
- Mutagenicity (Ames test) model (KNN/Read-Across) 1.0.0
- Year:
- 2 018
- Bibliographic source:
- VEGA software. Istituto Di Ricerche Farmacologiche Mario Negri.
- Report date:
- 2018
Materials and methods
Test guideline
- Qualifier:
- according to guideline
- Guideline:
- other: Guidance on information requirements and chemical safety assessment Chapter R.6: QSARs and grouping of chemicals.
- Version / remarks:
- May 2008
- Deviations:
- not applicable
Test material
- Reference substance name:
- Methyl 2,3-dichloropropionate
- EC Number:
- 222-940-2
- EC Name:
- Methyl 2,3-dichloropropionate
- Cas Number:
- 3674-09-7
- Molecular formula:
- C4H6Cl2O2
- IUPAC Name:
- methyl 2,3-dichloropropanoate
- Test material form:
- liquid
- Details on test material:
- Liquid colourless to yellow
Constituent 1
Results and discussion
Any other information on results incl. tables
EXPERIMENTAL DATA
Experimental value is Mutagen. Model prediction is Mutagen (good reliability).
Compound SMILES: O=C(OC)C(CCl)Cl
Experimental value: Mutagen
Predicted Mutagen activity: Mutagen
Molecules used for prediction: 1
Reliability: the predicted compound is into the Applicability Domain of the model
Remarks: none
Applicant's summary and conclusion
- Conclusions:
- KLOB-010 is considered as “Mutagen”, nevertheless it was not possible collecting the primary reference.
- Executive summary:
KLOB-010 is considered as “Mutagen”.
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.
