Registration Dossier

Physical & Chemical properties

Melting point / freezing point

Currently viewing:

Administrative data

Link to relevant study record(s)

Reference
Endpoint:
melting point/freezing point
Type of information:
(Q)SAR
Adequacy of study:
key 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:
Please refer to attached justification below.
Qualifier:
no guideline followed
Principles of method if other than guideline:
QSAR prediction
GLP compliance:
no
Type of method:
other: prediction by QSAR
Melting / freezing pt.:
-94.26 °C
Remarks on result:
other: Mean or Weighted MP
Melting / freezing pt.:
-113.2 °C
Remarks on result:
other: experimental value of -113.2°C reported in outcome report of the prediction
Conclusions:
Melting point of -94.26°C°C is calculated by MPBVP v1.4.3 (EPI Suite v4.11; USEPA).
Note that this endpoint is supported by experimental value of -113.2°C reported in outcome report of the prediction.
Executive summary:

Melting point of -94.26°C°C is calculated by MPBVP v1.4.3 (EPI Suite v4.11; USEPA).

Note that this endpoint is supported by experimental value of -113.2°C reported in outcome report of the prediction.

Description of key information

Melting point of -94.26°C°C is calculated by MPBVP v1.4.3 (EPI Suite v4.11; USEPA).

Note that this endpoint is supported by experimental value of -113.2°C reported in outcome report of the prediction.

Key value for chemical safety assessment

Melting / freezing point at 101 325 Pa:
-94.26 °C

Additional information