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Please be aware that this old REACH registration data factsheet is no longer maintained; it remains frozen as of 19th May 2023.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

Boiling point

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Administrative data

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Endpoint:
boiling point
Type of information:
experimental study
Adequacy of study:
key study
Reliability:
2 (reliable with restrictions)
Rationale for reliability incl. deficiencies:
data from handbook or collection of data
Justification for type of information:
Considered reliable data source and is in line with other sources of information including supplier SDS.
Qualifier:
no guideline followed
Principles of method if other than guideline:
Published data in readily available literature. Method: other: Handbook value
GLP compliance:
not specified
Type of method:
other: Literature data
Key result
Boiling pt.:
>= 154 - <= 202 °C
Atm. press.:
1 013 hPa
Conclusions:
Stoddard solvent has a Boiling point between 154°C and 202°C. Many references to the Boiling point in published literature.
Endpoint:
boiling point
Type of information:
(Q)SAR
Adequacy of study:
key study
Study period:
not applicable
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: US EPA accepted QSAR method for organic chemicals properties assessment.
Qualifier:
no guideline followed
Principles of method if other than guideline:
not applicable. QSAR model (Estimation: EPI Suite (Adapted Stein & Brown method))
GLP compliance:
no
Remarks:
not applicable. QSAR model
Type of method:
other: not applicable. QSAR model
Boiling pt.:
164.6 °C
Atm. press.:
1.73 mm Hg
Decomposition:
no
Remarks:
no data provided by method
Remarks on result:
other: Selected VP: 1.73 mm Hg (Mean of Antoine & Grain methods) : 231 Pa (Mean of Antoine & Grain methods)

Overview of QSARs estimations on Boiling Point of Stoddard solvent

 

Method

 

Results

Remarks

Reference

QSAR estimate

Boiling Point: 164.60 deg C (Adapted Stein and Brown Method)

Vapor Pressure Estimations (25 deg C): (Using BP: 174.10 deg C (exp database)) (MP not used for liquids)

VP: 1.89 mm Hg (Antoine Method) : 251 Pa (Antoine Method)

VP: 1.58 mm Hg (Modified Grain Method) : 211 Pa (Modified Grain Method) VP: 1.79 mm Hg (Mackay Method) : 239 Pa (Mackay Method)

Selected VP: 1.73 mm Hg (Mean of Antoine & Grain methods) : 231 Pa (Mean of Antoine & Grain methods)

 

 

Valid with restrictions (2); QSAR method;

Estimated values

MPBPWIN (v.1.43)
Conclusions:
Using the EPI Suite Mpbwin (v.1.43) QSAR model, a Boiling Point of 164.60 deg C (estimated) was established.
Executive summary:
Using the EPI Suite Mpbwin (v.1.43) QSAR model, a Boiling Point of 164.60 deg C (estimated) was established.

Description of key information

Stoddard solvent has a Boiling point between 154°C and 202°C. Many references to the Boiling point in published literature.

Using the EPI Suite Mpbwin (v.1.43) QSAR model, a Boiling Point of 164.60 deg C (estimated) was established.

Key value for chemical safety assessment

Boiling point at 101 325 Pa:
164.6 °C

Additional information