Registration Dossier
Registration Dossier
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EC number: 258-038-0 | CAS number: 52605-52-4
Boiling point
Administrative data
- Endpoint:
- boiling point
- Type of information:
- (Q)SAR
- Adequacy of study:
- key study
- Reliability:
- 2 (reliable with restrictions)
- Justification for type of information:
- QSAR prediction: migrated from IUCLID 5.6
Data source
Reference
- Reference Type:
- publication
- Title:
- No information
- Year:
- 2 012
- Bibliographic source:
- ChemSpider data base
Materials and methods
Test guideline
- Qualifier:
- no guideline followed
- Principles of method if other than guideline:
- Predicted data is generated using the ACD/Labs’ ACD/PhysChem Suite.
- GLP compliance:
- no
- Type of method:
- other: prediction using the ACD/Labs’ ACD/PhysChem Suite
Test material
- Reference substance name:
- 1-(3-chlorophenyl)-4-(3-chloropropyl)piperazinium chloride
- EC Number:
- 258-038-0
- EC Name:
- 1-(3-chlorophenyl)-4-(3-chloropropyl)piperazinium chloride
- Cas Number:
- 52605-52-4
- Molecular formula:
- C13H18Cl2N2.ClH
- IUPAC Name:
- 1-(3-chlorophenyl)-4-(3-chloropropyl)piperazin-1-ium chloride
Constituent 1
Results and discussion
Boiling point
- Boiling pt.:
- 395.8 °C
- Atm. press.:
- 760 mm Hg
Applicant's summary and conclusion
- Conclusions:
- The predicted value of boining point by the ACD/Labs’ ACD/PhysChem Suite is 395.8 °C at 760 mmHg.
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