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Physical & Chemical properties

Solubility in organic solvents / fat solubility

Administrative data

Endpoint:
solubility in organic solvents / fat solubility
Type of information:
experimental study
Adequacy of study:
supporting study
Study period:
between 13 October 2016 and 18 October 2017
Reliability:
2 (reliable with restrictions)
Rationale for reliability incl. deficiencies:
comparable to guideline study with acceptable restrictions

Data source

Reference
Reference Type:
study report
Title:
Unnamed
Year:
2017
Report date:
2017

Materials and methods

Test guideline
Qualifier:
no guideline followed
Principles of method if other than guideline:
This test is only performed to give an impression of the solubility of Tris[2-(3-mercaptopropionyloxy)ethyl]isocyanurate (TEMPIC) in different organic solvents. It does not claim to determine exact solubility in g/L.
GLP compliance:
no
Other quality assurance:
other: ISO 9001:2008

Test material

Constituent 1
Chemical structure
Reference substance name:
(2,4,6-trioxo-1,3,5-triazine-1,3,5(2H,4H,6H)-triyl)triethane-2,1-diyl tris(3-mercaptopropionate)
EC Number:
252-907-8
EC Name:
(2,4,6-trioxo-1,3,5-triazine-1,3,5(2H,4H,6H)-triyl)triethane-2,1-diyl tris(3-mercaptopropionate)
Cas Number:
36196-44-8
Molecular formula:
C18H27N3O9S3
IUPAC Name:
2-[2,4,6-trioxo-3,5-bis({2-[(3-sulfanylpropanoyl)oxy]ethyl})-1,3,5-triazinan-1-yl]ethyl 3-sulfanylpropanoate
Test material form:
liquid: viscous

Results and discussion

Solubility in organic solvents / fat solubilityopen allclose all
Key result
Medium:
other: n-hexane
Solubility:
< 0.1 g/L
Temp.:
20 °C
Key result
Medium:
acetonitrile
Solubility:
>= 1 000 g/L
Temp.:
20 °C
Key result
Medium:
ethanol
Solubility:
< 0.1 g/L
Temp.:
20 °C
Test substance stable:
not determined

Applicant's summary and conclusion

Conclusions:
Based on the definition in the European Pharmacopoeia, Tris[2-(3-mercaptopropionyloxy)ethyl]isocyanurate is infinitely soluble in Acetonitrile and insoluble in Hexane and Ethanol.