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Please be aware that this old REACH registration data factsheet is no longer maintained; it remains frozen as of 19th May 2023.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:
boiling 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: Data is from computational model developed by USEPA

Data source

Reference
Reference Type:
other: Prediction model
Title:
Boiling point by EPI (Estimation Programs Interface) Suite
Author:
Sustainability Support Service (Europe) AB - estimated
Year:
2016
Bibliographic source:
Estimation Programs Interface Suite™ United States Environmental Protection Agency, Washington, DC, USA. version 4.1

Materials and methods

Test guideline
Qualifier:
according to guideline
Guideline:
other: Modeling database
Principles of method if other than guideline:
MPBPVP (v1.43) Program
GLP compliance:
no
Type of method:
other: Adapted Stein and Brown Method

Test material

Constituent 1
Chemical structure
Reference substance name:
Hydroxyaluminium distearate
EC Number:
206-101-8
EC Name:
Hydroxyaluminium distearate
Cas Number:
300-92-5
Molecular formula:
C36H71AlO5
IUPAC Name:
hydroxyaluminium distearate
Test material form:
solid: particulate/powder
Remarks:
migrated information: powder
Details on test material:
Name of test material (as cited in study report): Aluminum distearate
Molecular formula (if other than submission substance): C36H71AlO5
Molecular weight (if other than submission substance): 610.9339
Smiles notation (if other than submission substance): CCCCCCCCCCCCCCCCCC(=O)O[Al](O)OC(=O)CCCCCCCCCCCCCCCCC
InChl (if other than submission substance): 1S/2C18H36O2.Al.H2O/c2*123456789101112131415161718(
19)20;;/h2*217H2,1H3,(H,19,20);;1H2/q;;+3;/p3
Substance Type: Organic
Physical State: Solid

Results and discussion

Boiling point
Boiling pt.:
673.64 °C
Remarks on result:
other: Other details not available

Applicant's summary and conclusion

Conclusions:
From EPI Suite modelling database Boiling point of test substance Aluminum distearate was estimated to be 673.64 deg C by Adapted Stein and Brown Method.
Executive summary:

From EPI Suite modelling database Boiling point of test substance Aluminum distearate was estimated to be 673.64 deg C by Adapted Stein and Brown Method.