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Physical & Chemical properties

Boiling point

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Administrative data

Endpoint:
boiling point
Type of information:
(Q)SAR
Adequacy of study:
key study
Study period:
2004
Reliability:
1 (reliable without restriction)
Justification for type of information:
QSAR prediction: migrated from IUCLID 5.6

Data source

Reference
Reference Type:
study report
Title:
Unnamed
Year:
2004
Report date:
2005

Materials and methods

Test guideline
Qualifier:
according to guideline
Guideline:
other: EPI Suite QSAR v3.11
GLP compliance:
yes (incl. QA statement)

Test material

Constituent 1
Chemical structure
Reference substance name:
-
EC Number:
466-280-5
EC Name:
-
Cas Number:
67643-70-3
Molecular formula:
C13H23NO2
IUPAC Name:
3,7-dimethylocta-1,6-dien-3-yl N,N-dimethylcarbamate
Details on test material:
Batch 9000575061
Purity: 97.4%

Results and discussion

Boiling point
Boiling pt.:
263.8 °C
Atm. press.:
31.2 hPa

Applicant's summary and conclusion

Conclusions:
The vapour pressure curve as a function of temperature could not be determined with GR-86-0999 according to the OECD method 104 (dynamic method) and thus could not be used to extrapolate the normal boiling point temperature.
The normal boiling point temperature was estimated using the EPI Suite QSAR : 536.8 K (263.8°C)