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Physical & Chemical properties

Explosiveness

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Administrative data

Endpoint:
explosiveness
Type of information:
calculation (if not (Q)SAR)
Adequacy of study:
key study
Study period:
Study Experimental Phase 2013-05-10 to 2013-05-23. Report complete 2013-06-18
Reliability:
2 (reliable with restrictions)
Rationale for reliability incl. deficiencies:
other: As the study is an estimation by calculation rather than a full experimental study, it is considered to meet the criteria for classification as reliable with restrictions according to Klimisch et al (1997).

Data source

Reference
Reference Type:
study report
Title:
Unnamed
Year:
2013
Report date:
2013

Materials and methods

Test guideline
Qualifier:
according to guideline
Guideline:
EU Method A.14 (Explosive properties)
Deviations:
no
Principles of method if other than guideline:
Under Column 2 ''Specific Rules for Adaptation from Column 1'' in the Regulation (EC) No 1907/2006 of the European Parliament and of the Council of 18 December 2006, it states the study does not need to be conducted if : ''there are no chemical groups associated with explosive properties present in the molecule'' accordingly ''The structure of the test material was assessed for chemical groups that imply explosive properties. Examples of such groups are C-C unsaturated, C-metal, N-metal, contiguous oxygen atoms, contiguous nitrogen atoms, N-halogens, O-halogens, N-O.''

The explosive properties were predicted using Method A14 Explosive Properties of Commission Regulation (EC) No 440/2008 of May 2008.
GLP compliance:
no

Test material

Constituent 1
Chemical structure
Reference substance name:
lithium 3-((3,4-dicyanophenyl)thio)propane-1-sulfonate
EC Number:
700-787-7
Cas Number:
769953-18-6
Molecular formula:
C11H9N2O3S2Li
IUPAC Name:
lithium 3-((3,4-dicyanophenyl)thio)propane-1-sulfonate
Test material form:
solid: particulate/powder

Results and discussion

Small-scale preliminary testsopen allclose all
Parameter:
other: More sensitive to shock than m-dinitrobenzene
Remarks:
migrated information
Remarks on result:
not measured/tested
Parameter:
other: More sensitive to friction than m-dinitrobenzene
Remarks:
migrated information
Remarks on result:
not measured/tested
Parameter:
other: Explosive under influence of flame
Remarks:
migrated information
Remarks on result:
not measured/tested
Parameter:
other: Explosive (not specified)
Remarks:
migrated information
Remarks on result:
negative (not further specified)
Remarks:
Based on the chemical structure of the test material

Applicant's summary and conclusion

Interpretation of results:
non explosive
Remarks:
Migrated information
Conclusions:
There are no structural alerts within the chemical structure of the test material. Therefore, based on the chemical structure of the test item the result for explosive proerties has been predicted negative.
Executive summary:

Introduction

This study was undertaken to predict the explosive properties of the test material using a procedure designed to be compatible with the following guideline:

Method A14 Explosive properties, Commission Regulation (EC) No 440/2008 of 30 May 2008.

Results & Conclusions

There are no structural alerts within the chemical structure of the test material. Therefore, based on the chemical structure of the test item the result for explosive proerties has been predicted negative.

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