Registration Dossier

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Please be aware that this old REACH registration data factsheet is no longer maintained; it remains frozen as of 19th May 2023.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.

Diss Factsheets

Administrative data

Endpoint:
acute toxicity: oral
Type of information:
(Q)SAR
Adequacy of study:
key study
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
Title:
ACD/Percepta
Year:
2017
Bibliographic source:
(Advanced Chemistry Development, Inc., Pharma Algorithms, Inc., release 2017)

Materials and methods

Principles of method if other than guideline:
QSAR predition
GLP compliance:
no
Test type:
other: QSAR

Test material

Constituent 1
Chemical structure
Reference substance name:
α-phenylpiperidine-2-acetic acid
EC Number:
243-020-7
EC Name:
α-phenylpiperidine-2-acetic acid
Cas Number:
19395-41-6
Molecular formula:
C13H17NO2
IUPAC Name:
α-phenylpiperidine-2-acetic acid
Test material form:
solid: granular
Specific details on test material used for the study:
C1CCNC(C1)C(C2=CC=CC=C2)C(=O)O

Test animals

Species:
rat
Strain:
not specified
Sex:
not specified

Results and discussion

Effect levels
Sex:
not specified
Dose descriptor:
LD50
Effect level:
370 mg/kg bw

Applicant's summary and conclusion

Interpretation of results:
Category 4 based on GHS criteria
Conclusions:
The LD50 QSAR prediction was assessed as adequate for regulatory purposes.
Predicted value (model result): LD50 = 370 mg/kg