3-amino-5-nitrosalicylic acid

Genetic toxicity: in vitro

Administrative data

Endpoint:

in vitro gene mutation study in bacteria

Remarks:

Type of genotoxicity: gene mutation

Type of information:

(Q)SAR

Adequacy of study:

other information

Study period:

2017

Reliability:

2 (reliable with restrictions)

Rationale for reliability incl. deficiencies:

accepted calculation method

Data source

Reference

Reference Type:

other company data

Title:

Unnamed

Year:

2017

Report date:

2017

Materials and methods

Test guideline

Qualifier:

according to guideline

Guideline:

other: REACH Guidance on QSARs R.6

GLP compliance:

no

Type of assay:

bacterial reverse mutation assay

Test material

Test material information

Constituent 1

Reference substance name:

3-amino-2-hydroxy-5-nitrobenzoic acid

EC Number:

212-602-2

Cas Number:

831-51-6

Molecular formula:

C7H6N2O5

IUPAC Name:

3-amino-2-hydroxy-5-nitrobenzoic acid

Test material form:

solid: particulate/powder

Results and discussion

Test results

Key result

Species / strain:

not specified

Remarks:

QSAR estimation

Genotoxicity:

negative

Additional information on results:

RANGE-FINDING/SCREENING STUDIES:
A toxic screen was run with the test compound at concentrations of 10, 3, 1, 0.2, 0.04 and 0.01 mg/plate using Salmonella tester strain TA100. In the absence and
presence of metabolic activation, a maximum concentration of

Any other information on results incl. tables

The prediction was based on dataset comprised from the following descriptors: "gene mutation"
Estimation method: Takes highest mode value from the 5 nearest neighbours
Domain  logical expression:Result: In Domain

(("a" and ("b" and ( not "c") )  )  and ("d" and "e" )  )

Domain logical expression index: "a"

Referential boundary: The target chemical should be classified as Nitro-aromatic AND Primary aromatic amine,hydroxyl amine and its derived esters by in vitro mutagenicity (Ames test) alerts by ISS

Domain logical expression index: "b"

Referential boundary: The target chemical should be classified as Aniline AND Aryl AND Carboxylic acid AND Nitrobenzene AND Phenol by Organic Functional groups

Domain logical expression index: "c"

Referential boundary: The target chemical should be classified as Acridine OR Alcohol OR Alkene OR Alkoxy OR Alkyl arenes OR Amidine OR Aminoaniline, meta OR Aminoaniline, ortho OR Aminoaniline, para OR Anthracenone/ Antracendione OR Aromatic amine OR Aryl halide OR Azo OR Benzyl OR Biphenyl OR Carbazole OR Carbohydrate/ Monosaccharide OR Conjugated system OR Cycloketone OR Dianilines OR Dihydroxyl group OR Diketone OR Dinitro aniline OR Ether OR Ether, cyclic OR Fluorene OR Formylamino OR Furane OR Fused carbocyclic aromatic OR Fused heterocyclic aromatic OR Fused saturated heterocycles OR Hydroxamic acid OR Imidazole OR Isocyanate OR Isopropyl OR Naphtalene OR N-Hydroxylamine derivatives OR Nitrile OR Nitro aliphatic congugated OR No functional group found OR Oxolane OR Phenanthrene OR Precursors quinoid compounds OR Purine derivatives OR Pyridine/ Pyridinium ion OR Pyrimidine OR Quinoline/ Isoquinoline OR Saturated heterocyclic fragment OR Sulfide OR Thiadiazole OR Thiazole/ Isothiazole OR Thiophene OR Triazine OR Unsaturated heterocyclic fragment by Organic Functional groups

Domain logical expression index: "d"

Parametric boundary:The target chemical should have a value of log Kow which is >= 1.47

Domain logical expression index: "e"

Parametric boundary:The target chemical should have a value of log Kow which is <= 2.02

Applicant's summary and conclusion

Conclusions:

Based on the analysis using OECD QSAR toolbox, the substance is considered as non-mutagenic.

Executive summary:

Based on the analysis using OECD QSAR toolbox, the substance is considered as non-mutagenic.