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Please be aware that this old REACH registration data factsheet is no longer maintained; it remains frozen as of 19th May 2023.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:
density
Remarks:
density
Type of information:
calculation (if not (Q)SAR)
Remarks:
Migrated phrase: estimated by calculation
Adequacy of study:
key study
Reliability:
4 (not assignable)
Rationale for reliability incl. deficiencies:
other: Data is from ACD/PhysChem Suite

Data source

Reference
Reference Type:
review article or handbook
Title:
Physical data for Cas no.13081-18-0
Author:
Chemspider - ACD/PhysChem Suite
Year:
2012
Bibliographic source:
ChemSpider- Free chemical Database, Royal Society of Chemistry.

Materials and methods

Principles of method if other than guideline:
Data is from Chemspider - ACD/PhysChem Suite
GLP compliance:
not specified
Type of method:
other: estimated

Test material

Constituent 1
Chemical structure
Reference substance name:
ethyl 3,3,3-trifluoro-2-oxopropanoate
EC Number:
603-440-7
Cas Number:
13081-18-0
Molecular formula:
C5H5F3O3
IUPAC Name:
ethyl 3,3,3-trifluoro-2-oxopropanoate
Details on test material:
- Name of test material (as cited in study report): Ethyl 3,3,3-trifluoropyruvate
- Molecular formula: C5H5F3O3
- Molecular weight: 170.08 g/mol
- Smiles notation: C(F)(F)(F)C(=O)C(=O)OCC
- Substance type: Organic
- Physical state: liquid

Results and discussion

Density
Type:
density
Density:
1.3 g/cm³
Remarks on result:
other: Temp. not available

Applicant's summary and conclusion

Conclusions:
Density of the test substance Ethyl 3,3,3-trifluoropyruvate was predicted to be 1.3±0.1 g/cm3.
Executive summary:

Density of the test substance Ethyl 3,3,3-trifluoropyruvate was predicted to be 1.3±0.1 g/cm3.