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Physical & Chemical properties

Boiling point

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Reference
Endpoint:
boiling point
Type of information:
experimental study
Adequacy of study:
key study
Study period:
09/15 February 2021
Reliability:
1 (reliable without restriction)
Rationale for reliability incl. deficiencies:
guideline study
Remarks:
GLP study carried out according to OECD / EU guidelines.
Qualifier:
according to guideline
Guideline:
EU Method A.2 (Boiling Temperature)
Version / remarks:
2008
Deviations:
no
Qualifier:
according to guideline
Guideline:
OECD Guideline 103 (Boiling Point)
Version / remarks:
1995
Deviations:
no
GLP compliance:
yes (incl. QA statement)
Remarks:
Inspected on 15/16 Nov. 2017, signed on 15 May 2018
Type of method:
differential scanning calorimetry
Specific details on test material used for the study:
Appearance: yellow to red, clear liquid
Storage room temperature: 20 ± 5 °C (293.15 ±5 K)
Key result
Boiling pt.:
ca. 205.26 °C
Atm. press.:
ca. 1 011.9 mBar

Results Pre-Test:


All observations of the Pre-Test for Boiling Point and Safety Test are presented in the following tables:


Table 1 Pre-Test for Boiling Point and Safety Test

































ObservationsTemperatures in °C
Individual bubblefrom 51
Condensate was visiblefrom 76
More condensatefrom 110
Bubbles came fasterfrom 160
Bubble chain began with boiling delay, fizzle and gas
in head space, for safety reasons the heating plate
was turned off
210
The test item was visually unchangedafter cooling down

Security test for the DSC instrument:


The crucible was found visually unchanged after reaching a temperature of 200 °C, 300 °C,400 °C and 450 °C. The weight of the crucible was recorded with 45.17 mg (weight loss: 2.18 mg, i.e 89.3% of substance).


Table 2 - Values DSC Test Item Pre-Test






























Boiling point Temperature [°C] Energy (J/g) / Heat flow (mW)
Begin 156.6518.52 mW
Onset 205.77193.41 J/g
Peak max. 277.43-
End 337.2317.12 mW

Table 3-Values Observations



















 Mass test itemMass crucible
(before measurement):
Mass crucible
(after measurement):

Observations
DSC P re-test2.80 mg47.34 mg44.66 mgAfter the test the crucible was
visually unchanged (weight loss: 2.68 mg, i.e. : 95.7%)

Results - Test Method following DSC (Main-test):


After calibration with indium and zinc the measurement of indium yielded the following values:


Table 4 - Values DSC Indium:



















Expected
Melting point
Measured
Melting point
Expected
Energy
Measured
Energy
Assessment
156.6 ± 1.0°C156.83 °C (onset)28.45 ± 1.0 J/g27.64 J/gOK

The ambient atmospheric pressure was recorded to be 1011.9 mbar.


Table 5 - Values DSC Test Item first determination






























Boiling point Temperature [°C] Energy (J/g) / Heat flow (mW)
Begin 162.1518.75 mW
Onset 205.12158.28 J/g
Peak max. 284.26-
End 340.16

16.84 mW



The ambient atmospheric pressure was recorded to be 1011.9 mbar


Table 6 - Values DSC Test Item second determination






























Boiling point Temperature [°C] Energy (J/g) / Heat flow (mW)
Begin 162.1518.88 mW
Onset 205.39156.51 J/g
Peak max. 284.4-
End 340.1416.87 mW

Table 7 - Values Observations


























 Mass test itemMass crucible
(before measurement):
Mass crucible
(after measurement):

Observations
First
Measurement
4.15 mg49.80 mg45.81 mgAfter the test the crucible was
visually unchanged (weight loss: 3.99 mg, i.e. : 96.1%)
Second
Measurement
4.18 mg49.41 mg45.35 mgAfter the test the crucible was
visually unchanged (weight loss: 4.06 mg, i.e. : 97.1%)

Table 8 - Presentation of Results:


All results are presented in the following table.





























































































































 Boiling point Temperature [°C] Temperature [K]
1st  DeterminationBegin 162.15435.30
2nd DeterminationBegin 162.15435.30
 Mean162.15435.30
 Sd0.000.00
    
1st  DeterminationEnd 340.16613.31
2nd DeterminationEnd 340.14613.29
 Mean340.15613.30
 Sd0.010.01
    
1st  DeterminationOnset 205.12478.27
2nd DeterminationOnset 205.39478.54
 Mean205.26478.41
 Sd0.190.19
    
1st  DeterminationPeak max. 284.26557.41
2nd DeterminationPeak max. 284.40557.55
 Mean284.33557.48
 Sd0.100.10

 


 

Conclusions:
Under the test conditions, at the pressure of 1011.9 mBar, the mean onset for boiling occurred at 205.26°C (478.41 K).



Executive summary:

The boiling point of the test substance was determined under GLP according to OECD 103 / EU A.2 guideline, using differential scanning calorimetry (DSC) method.
Two main runs were performed under inert gas atmosphere at the pressure of 1011.9 mBar, and the mean temperature was retained.
In all runs one event was detected. The event is endotherm and is stated as the boiling point.
Under the test conditions, at the pressure of 1011.9 mBar, the mean onset for boiling occurred at 205.26°C (478.41 K).


 

Description of key information

Under the test conditions, at the pressure of 1011.9 mBar, the mean onset for boiling occurred at 205.26°C (478.41 K).


 

Key value for chemical safety assessment

Additional information

A fully reliable experimental study, conducted according to a recognized OECD 103 / EU A.2 method and under GLP, is available.
It is considered as a key study, and the result is retained as key data.