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Diss Factsheets

Physical & Chemical properties

Boiling point

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Endpoint:
boiling point
Type of information:
(Q)SAR
Adequacy of study:
supporting study
Reliability:
2 (reliable with restrictions)
Rationale for reliability incl. deficiencies:
results derived from a valid (Q)SAR model and falling into its applicability domain, with adequate and reliable documentation / justification
Justification for type of information:
QSAR prediction
Principles of method if other than guideline:
The result was obtained using an appropriate QSAR method (see attached QMRF and QPRF for details).
GLP compliance:
no
Type of method:
other: QSAR
Boiling pt.:
78 °C
Atm. press.:
101.3 kPa
Conclusions:
A boiling point value of 78°C at 101.3 kPa has been obtained for the test substance using an accepted calculation method. The result is considered reliable.
Endpoint:
boiling point
Type of information:
experimental study
Adequacy of study:
supporting study
Study period:
06 Nov to 25 Nov 2014
Reliability:
1 (reliable without restriction)
Rationale for reliability incl. deficiencies:
guideline study
Qualifier:
according to guideline
Guideline:
OECD Guideline 103 (Boiling point/boiling range)
Qualifier:
according to guideline
Guideline:
EU Method A.2 (Boiling Temperature)
Version / remarks:
1.4.7 / 1.6.6.2
GLP compliance:
no
Type of method:
photocell detection
Remarks:
capillary tube method
Boiling pt.:
75.1 °C
Atm. press.:
1 013 hPa
Remarks on result:
other: Atmospheric pressure assumed to be normal

Results of capillary tube method / Photocell detectionmetry

Test

Measured boiling temperature

Measured atmospheric pressure

Boiling temperature

corrected to normal atmospheric pressure

 

°C

K

kPa

°C

K

1

73.6

346.8

96.1

75.1

348.3

2

73.5

346.7

96.1

75.0

348.2

 

 

 

 

 

 

Mean value

73.6

346.8

 

75.1

348.3

 

At small deviations from the normal pressure (max. ± 5 kPa) the boiling temperatures are normalized to Tn by means of the number-value equation by Sidney Young.

 

Conclusions:
A boiling point value of 75.1 °C at 1013 hPa was determined in a reliable study conducted according to an appropriate test protocol. It was not compliant with GLP.
Endpoint:
boiling point
Type of information:
experimental study
Adequacy of study:
key study
Study period:
06 Nov to 25 Nov 2014
Reliability:
1 (reliable without restriction)
Rationale for reliability incl. deficiencies:
guideline study
Qualifier:
according to guideline
Guideline:
OECD Guideline 103 (Boiling point/boiling range)
Qualifier:
according to guideline
Guideline:
EU Method A.2 (Boiling Temperature)
Version / remarks:
1.4.7 / 1.6.6.2
GLP compliance:
no
Type of method:
differential scanning calorimetry
Boiling pt.:
75.8 °C
Atm. press.:
1 013 hPa
Remarks on result:
other: Atmospheric pressure assumed to be normal

Results of differential scanning calorimetry

Test

Measured boiling temperature

Measured atmospheric pressure

Boiling temperature

corrected to normal atmospheric pressure

 

°C

K

kPa

°C

K

1

74.3

347.5

96.2

75.8

349.0

2

74.3

347.5

96.0

75.8

349.0

 

 

 

 

 

 

Mean value

74.3

347.5

 

75.8

349.0

 

At small deviations from the normal pressure (max. ± 5 kPa) the boiling temperatures are normalized to Tn by means of the number-value equation by Sidney Young.

Conclusions:
A boiling point value of 75.8 °C at 1013 hPa was determined in a reliable study conducted according to an appropriate test protocol. It was not compliant with GLP.

Description of key information

Ethoxytrimethylsilane: 75.8°C at 1013 hPa (DCS, EU Method A.2)

Key value for chemical safety assessment

Boiling point at 101 325 Pa:
75.8 °C

Additional information

A boiling point value of 75.8 °C (1013 hPa) was determined by differential scanning calorimetry according to EU Method A.2. In a supporting study a boiling point value of 75.1 °C (1013 hPa) was determined by capillary tube method (photocell detection) according to EU Method A.2. Additionally, a predicted boiling point value of 78 °C at 1013 hPa was obtained using an accepted calculation method (QSAR). The result is considered to be reliable.