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Please be aware that this old REACH registration data factsheet is no longer maintained; it remains frozen as of 19th May 2023.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

Physical & Chemical properties

Partition coefficient

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Administrative data

Endpoint:
partition coefficient
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: accepted calculation method

Data source

Reference
Reference Type:
other: QSAR
Title:
unpublished calculation
Author:
BASF SE, D-67056 Ludwigshafen
Year:
2003
Bibliographic source:
online query 16 May 2003

Materials and methods

Principles of method if other than guideline:
other: calculated: SRC KOWWIN v1.66
GLP compliance:
no
Partition coefficient type:
octanol-water

Test material

Constituent 1
Chemical structure
Reference substance name:
2,4,6-trimethylbenzoyl chloride
EC Number:
213-339-6
EC Name:
2,4,6-trimethylbenzoyl chloride
Cas Number:
938-18-1
Molecular formula:
C10H11ClO
IUPAC Name:
2,4,6-trimethylbenzoyl chloride

Results and discussion

Partition coefficient
Type:
log Pow
Partition coefficient:
2.42
Temp.:
25 °C

Any other information on results incl. tables

Study was performed without considering the pH value.

Applicant's summary and conclusion