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Administrative data

Endpoint:
vapour pressure
Type of information:
(Q)SAR
Adequacy of study:
weight of evidence
Reliability:
1 (reliable without restriction)
Rationale for reliability incl. deficiencies:
accepted calculation method
Justification for type of information:
The result was obtain by (Q)SAR calculation and compared to the available data in GESTIS database. The original data sources are traceble.

Data source

Reference
Reference Type:
other: (Q)SAR Toolbox prediction Category report
Title:
Unnamed
Year:
2018
Report date:
2018

Materials and methods

Test guideline
Qualifier:
no guideline available
Principles of method if other than guideline:
Predicted endpoint (OECD Principle 1 - defined endpoint): Physical Chemical Properties -> Vapour
pressure
GLP compliance:
not specified

Test material

Constituent 1
Chemical structure
Reference substance name:
Isopropyl nitrate
EC Number:
216-983-6
EC Name:
Isopropyl nitrate
Cas Number:
1712-64-7
Molecular formula:
C3H7NO3
IUPAC Name:
propan-2-yl nitrate
Test material form:
liquid

Results and discussion

Vapour pressureopen allclose all
Key result
Test no.:
#1
Temp.:
ca. 20 °C
Vapour pressure:
ca. 37.5 - ca. 37.5 mm Hg
Remarks on result:
other: the result is a (Q)SAR prediction
Test no.:
#2
Temp.:
ca. 20 °C
Vapour pressure:
ca. 36 - ca. 36 hPa
Remarks on result:
other: data from GESTIS databese

Applicant's summary and conclusion

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