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Please be aware that this old REACH registration data factsheet is no longer maintained; it remains frozen as of 19th May 2023.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:
(Q)SAR
Adequacy of study:
weight of evidence
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 limited documentation / justification
Justification for type of information:
1. SOFTWARE
EPI Suite Version 4.11

2. MODEL (incl. version number)
EPI Suite Version 4.11

3. SMILES OR OTHER IDENTIFIERS USED AS INPUT FOR THE MODEL
[Si](OC)(OC)(OC)CCCN(C)C

4. SCIENTIFIC VALIDITY OF THE (Q)SAR MODEL
The Estimation Programs Interface (EPI) Suite TM was developed by the US Enviromental Protection Agency's Offic of Pollution Prevention and Toxic and Syracuse Research Corporation (SRC). It is screening-level tool, intended for use in applications such as to quickly screen chemicals for release potential and "bin" chemicals by priority for future work. Estimated values should not be used when experimental (measured) values are available.

Data source

Reference
Title:
EPI Suite Version 4.11
Year:
2012
Bibliographic source:
Boiling Pt, Melting Pt, Vapor Pressure Estimations (MPBPVP v1.43)

Materials and methods

Test guideline
Guideline:
other: REACH Guidance on QSARs R.6

Test material

Constituent 1
Chemical structure
Reference substance name:
N,N-dimethyl-3-(trimethoxysilyl)propylamine
EC Number:
219-786-3
EC Name:
N,N-dimethyl-3-(trimethoxysilyl)propylamine
Cas Number:
2530-86-1
Molecular formula:
C8H21NO3Si
IUPAC Name:
dimethyl[3-(trimethoxysilyl)propyl]amine
Specific details on test material used for the study:
SMILES : [Si](OC)(OC)(OC)CCCN(C)C

Results and discussion

Melting / freezing point
Key result
Melting / freezing pt.:
10.49 °C
Atm. press.:
1 013 Pa
Remarks on result:
other:
Remarks:
QSAR predicted value

Any other information on results incl. tables

EPI Suite predicted that N,N-Dimethyl-3-(trimethoxysilyl)propylamine has a melting point = 10.49°C.

Applicant's summary and conclusion

Conclusions:
EPI Suite predicted that N,N-Dimethyl-3-(trimethoxysilyl)propylamine has a melting point = 10.49°C.