Registration Dossier

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Please be aware that this old REACH registration data factsheet is no longer maintained; it remains frozen as of 19th May 2023.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

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
Reliability:
2 (reliable with restrictions)
Rationale for reliability incl. deficiencies:
other: Internationally accepted method, EPI-Suite, EPA (USA)

Data source

Reference
Reference Type:
other: calculation
Title:
Unnamed
Year:
2010

Materials and methods

Principles of method if other than guideline:
Calculation by EPI-Suite, EPA (USA) / MPBPWIN v1.42
Type of method:
other: estimated by calculation

Test material

Constituent 1
Chemical structure
Reference substance name:
2-phenylthioaniline
EC Number:
413-030-8
EC Name:
2-phenylthioaniline
Cas Number:
1134-94-7
Molecular formula:
C12H11NS
IUPAC Name:
2-(phenylsulfanyl)aniline

Results and discussion

Melting / freezing point
Melting / freezing pt.:
104.05 °C
Remarks on result:
other: (Mean or Weighted MP)

Applicant's summary and conclusion

Conclusions:
The estimated melting point is 104.05 ºC (EPI-Suite, MPBPWIN v1.42).
Executive summary:

The estimated melting point is 104.05 ºC (EPI-Suite, MPBPWIN v1.42).