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Please be aware that this old REACH registration data factsheet is no longer maintained; it remains frozen as of 19th May 2023.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: inhalation
Type of information:
(Q)SAR
Adequacy of study:
key study
Reliability:
2 (reliable with restrictions)
Justification for type of information:
QSAR prediction: migrated from IUCLID 5.6

Data source

Reference
Reference Type:
other: Predicted data
Title:
R: QSAR Toolbox 2.3.0.1132 prediction for LC50 read across evaluation for 100-01-6
Author:
Sustainability Support Services (Europe) AB
Year:
2012
Bibliographic source:
QSAR Toolbox version 2.3

Materials and methods

Test guideline
Qualifier:
according to guideline
Guideline:
other: Not Applicable;OECD Guideline 403 (Acute Inhalation Toxicity)
GLP compliance:
no
Test type:
other: Acute Rodent Inhalation Toxicity Test

Test material

Constituent 1
Chemical structure
Reference substance name:
4-nitroaniline
EC Number:
202-810-1
EC Name:
4-nitroaniline
Cas Number:
100-01-6
Molecular formula:
C6H6N2O2
IUPAC Name:
4-nitroaniline
Details on test material:
- Name of test material (as cited in study report): 4-nitroaniline
- Substance type: Organic
- Physical state: solid

Test animals

Species:
rat
Strain:
Wistar
Sex:
male

Administration / exposure

Route of administration:
inhalation
Type of inhalation exposure:
other: Inhalation: Vapor
Vehicle:
other: Unchanged (No Vehicle/Air)
Duration of exposure:
4 h
No. of animals per sex per dose:
6 animals
Control animals:
not specified

Results and discussion

Effect levels
Sex:
male
Dose descriptor:
LC50
Effect level:
47.485 ppm
Based on:
test mat.
Exp. duration:
4 h

Any other information on results incl. tables






The prediction was based on dataset comprised from the following descriptors: LC50
Estimation method: Taking average value from the 4 nearest neighbours
Domain logical expression:Result: In Domain

("a" and ("b" and "c" ) )

Domain logical expression index: "a"

Similarity boundary:Target: c1(N)ccc(N(=O)=O)cc1
Threshold=50%,
Dice(Atom pairs)

Domain logical expression index: "b"

Parametric boundary:The target chemical should have a value of log Kow which is >= 0.348

Domain logical expression index: "c"

Parametric boundary:The target chemical should have a value of log Kow which is <= 2.58

Applicant's summary and conclusion

Interpretation of results:
not classified
Remarks:
Migrated information Criteria used for interpretation of results: EU
Conclusions:
Inhalation toxicity (LC50 value) of 4-nitroaniline vapours was examined for 4 hrs.in male Wistar rat at a dose concentration (LC50) of 47.48475 ppm.This value suggests that the chemical 4-nitroaniline is non toxic to Wistar rat by the inhalation route.
Executive summary:

Inhalation toxicity (LC50 value) of 4-nitroaniline vapours was examined for 4 hrs.in male Wistar rat at a dose concentration (LC50) of 47.48475 ppm.This value suggests that the chemical 4-nitroaniline is non toxic to male Wistar rat by the inhalation route.