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Please be aware that this old REACH registration data factsheet is no longer maintained; it remains frozen as of 19th May 2023.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:
water solubility
Type of information:
calculation (if not (Q)SAR)
Remarks:
Migrated phrase: estimated by calculation
Adequacy of study:
weight of evidence
Reliability:
2 (reliable with restrictions)
Rationale for reliability incl. deficiencies:
other: scientifically accepted software

Data source

Reference
Reference Type:
other: QSAR
Title:
unpublished calculation
Author:
BASF SE, D-67056 Ludwigshafen
Year:
2011
Bibliographic source:
SPARC, online query 23 Mar 2011

Materials and methods

Principles of method if other than guideline:
other: calculated
GLP compliance:
no

Test material

Constituent 1
Chemical structure
Reference substance name:
p-phenylbenzonitrile
EC Number:
220-860-2
EC Name:
p-phenylbenzonitrile
Cas Number:
2920-38-9
Molecular formula:
C13H9N
IUPAC Name:
biphenyl-4-carbonitrile

Results and discussion

Water solubility
Water solubility:
19.33 mg/L
Temp.:
25 °C

Any other information on results incl. tables

Calculation was performed without adjustment of pH value.

Applicant's summary and conclusion