Registration Dossier
Registration Dossier
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EC number: 222-977-4 | CAS number: 3687-18-1
Melting point / freezing point
Administrative data
- Endpoint:
- melting point/freezing point
- Type of information:
- calculation (if not (Q)SAR)
- Remarks:
- Migrated phrase: estimated by calculation
- Adequacy of study:
- key study
- Study period:
- 2010
- Reliability:
- 2 (reliable with restrictions)
Data source
Reference
- Reference Type:
- other: in silico prediction
- Title:
- Unnamed
- Year:
- 2 010
Materials and methods
Test guideline
- Qualifier:
- no guideline available
- Principles of method if other than guideline:
- ACD/PhysChem Suite is a suite of comprehensive tools for the prediction of basic physicochemical properties.
- GLP compliance:
- not specified
- Type of method:
- other: prediction
Test material
- Reference substance name:
- 3-aminopropane-1-sulphonic acid
- EC Number:
- 222-977-4
- EC Name:
- 3-aminopropane-1-sulphonic acid
- Cas Number:
- 3687-18-1
- Molecular formula:
- C3H9NO3S
- IUPAC Name:
- 3-aminopropane-1-sulfonic acid
Constituent 1
Results and discussion
Melting / freezing point
- Melting / freezing pt.:
- > 270 °C
- Atm. press.:
- 1 013 mBar
- Remarks on result:
- other: other information not available
Applicant's summary and conclusion
- Conclusions:
- The predicted melting point is >270°C at 1013 mbar.
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