Registration Dossier
Registration Dossier
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EC number: 831-973-7 | CAS number: 147116-67-4
Melting point / freezing point
Administrative data
- Endpoint:
- melting point/freezing point
- Type of information:
- experimental study
- Adequacy of study:
- key study
- Study period:
- The experimental start date was 14 May 2019, and the experimental completion date was 16 May 2019.
- Reliability:
- 1 (reliable without restriction)
- Rationale for reliability incl. deficiencies:
- guideline study
Data source
Reference
- Reference Type:
- study report
- Title:
- Unnamed
- Year:
- 2 019
- Report date:
- 2019
Materials and methods
Test guidelineopen allclose all
- Qualifier:
- according to guideline
- Guideline:
- EPA OPPTS 830.7200 (Melting Point / Melting Range)
- Version / remarks:
- Melting Point/Melting Range. March 1998.
- Deviations:
- yes
- Remarks:
- Melting or boiling, is indicated by a deviation from the base line in the heat flow record. Because melting and boiling are processes in which heat is consumed, the deviation from the base line is in the endothermic direction for these processes.
- Qualifier:
- according to guideline
- Guideline:
- other: EC A.1
- Version / remarks:
- Melting/Freezing Temperature. March 04, 2016.
- Deviations:
- no
- Qualifier:
- according to guideline
- Guideline:
- OECD Guideline 102 (Melting point / Melting Range)
- Version / remarks:
- Melting Point / Melting Range. July 27, 1995.
- Deviations:
- no
- GLP compliance:
- yes (incl. QA statement)
- Type of method:
- differential scanning calorimetry
Test material
- Reference substance name:
- (2S,3S)-2-benzhydryl-N-[(5-tert-butyl-2-methoxy-phenyl)methyl]quinuclidin-3-amine
- EC Number:
- 831-973-7
- Cas Number:
- 147116-67-4
- Molecular formula:
- C32H40N2O
- IUPAC Name:
- (2S,3S)-2-benzhydryl-N-[(5-tert-butyl-2-methoxy-phenyl)methyl]quinuclidin-3-amine
- Test material form:
- solid
- Details on test material:
- White to off-white powder.
Storage Conditions: At room temperature.
Constituent 1
Results and discussion
Melting / freezing point
- Key result
- Melting / freezing pt.:
- ca. 131.9 °C
- Atm. press.:
- ca. 101 325 Pa
- Decomposition:
- yes
- Decomp. temp.:
- >= 325 °C
- Sublimation:
- no
Any other information on results incl. tables
Experiment |
1 |
2 |
Sample amount (mg) |
1.82 |
1.38 |
Initial temperature (°C) |
25 |
25 |
Rate (°C/minute) |
20 |
20 |
End temperature (°C) |
400 |
150 |
Applicant's summary and conclusion
- Conclusions:
- The melting and boiling temperature of Maropitant base (CJ-11,972) were determined by DSC.
The melting temperature of the test item was 131.9°C (405.0K).
Reaction and/or decomposition of the test item was observed during DSC experiments starting at 325°C (598K). Boiling of the test item was not observed below the temperature at which reaction and/or decomposition started. Based on this, the test item has no boiling temperature. - Executive summary:
The melting temperature of the test item was 131.9°C (405.0K).
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