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Please be aware that this old REACH registration data factsheet is no longer maintained; it remains frozen as of 19th May 2023.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

Physical & Chemical properties

Density

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Administrative data

Link to relevant study record(s)

Reference
Endpoint:
density, other
Remarks:
Density
Type of information:
calculation (if not (Q)SAR)
Adequacy of study:
key study
Reliability:
2 (reliable with restrictions)
Rationale for reliability incl. deficiencies:
accepted calculation method
Justification for type of information:
Predicted data from ACD/Labs
Qualifier:
according to guideline
Guideline:
other: as mentioned below
Principles of method if other than guideline:
ACD/I-Lab accepts smiles of test item and predicted data for density using v12.1.0.50375.
GLP compliance:
not specified
Type of method:
other: Predicted data from ACD/Labs
Specific details on test material used for the study:
Name of test material : 2-[(4-aminophenyl) amino]-5-nitrobenzenesulfonic acid
Molecular formula : C12H11N3O5S
Molecular weight : 309.301 g/mol
Physical Appearence : Solid
Smiles notation : O=S(=O)(O)c1c(Nc2ccc(N)cc2)ccc([N+]([O])=O)c1
InChl : GSITZZUEHIPPMH-UHFFFAOYSA-N
Key result
Type:
density
Density:
1.607 g/cm³
Remarks on result:
other: Estimated value
Conclusions:
Based on prediction done using ACD/I-Lab 2.0,the densityt of test chemical was estimated to be 1.607 g/cm3
Executive summary:

Based on prediction done using ACD/I-Lab 2.0,the density of test chemical was estimated to be 1.607 g/cm3

Description of key information

Predicted value of density of 2 -[(4 -aminophenyl) amino]-5 -nitrobenzenesulfonic acid is 1.607 g/cm3

Key value for chemical safety assessment

Additional information

Predicted value of density of 2 -[(4 -aminophenyl) amino]-5 -nitrobenzenesulfonic acid is 1.607 g/cm3