Registration Dossier

Administrative data

Endpoint:
vapour pressure
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: the value was determined by an appropriate QSAR method

Data source

Reference
Reference Type:
other company data
Title:
Unnamed
Year:
2012
Report date:
2012

Materials and methods

Principles of method if other than guideline:
QSAR estimation, ACD software V11.02
GLP compliance:
no
Type of method:
other: estimated

Test material

Constituent 1
Chemical structure
Reference substance name:
2-[2-(2-amino-6-chloro-9H-purin-9-yl)ethyl]propane-1,3-diol
EC Number:
923-654-7
Cas Number:
172529-94-1
Molecular formula:
C10H14N5O2Cl
IUPAC Name:
2-[2-(2-amino-6-chloro-9H-purin-9-yl)ethyl]propane-1,3-diol

Results and discussion

Vapour pressure
Temp.:
25 °C
Vapour pressure:
< 0 Torr

Applicant's summary and conclusion