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Dissociation constant

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Reference
Endpoint:
dissociation constant
Type of information:
experimental study
Adequacy of study:
key study
Study period:
18.05.2012 to 07.06.2012
Reliability:
1 (reliable without restriction)
Rationale for reliability incl. deficiencies:
test procedure in accordance with national standard methods
Justification for type of information:
Experimental test result performed using standard test guidelines
Qualifier:
according to guideline
Guideline:
other: as mention below
Principles of method if other than guideline:
Measurement of capacity of a compound to dissociate into respective ions.
GLP compliance:
no
Other quality assurance:
ISO/IEC 17025 (General requirements for the competence of testing and calibration laboratories)
Specific details on test material used for the study:
- Name of test material (IUPAC name): 4-(5,5,6-trimethylbicyclo[2.2.1]hept-2-yl)cyclohexan-1-ol
- Molecular formula: C16H28O
- Molecular weight: 236.396 g/mol
- Smiles notation: OC1CCC([C@@H]2[C@@H]3C[C@@H](C(C)(C)[C@@H]3C)C2)CC1
- InChl: 1S/C16H28O/c1-10-14-8-12(16(10,2)3)9-15(14)11-4-6-13(17)7-5-11/h10-15,17H,4-9H2,1-3H3
- Substance type: Organic
- Physical state: liquid
Dissociating properties:
not determined
No.:
#1
pKa:
0
Temp.:
30 °C
Remarks on result:
other: pKa: 0.0000000000000237 (0.23 x 10-13)
Conclusions:
The experimental pKa value for test chemical was determine to be 0.0000000000000237(0.23 x 10-13) at 30 degC indicating that it has dissociation properties.
Executive summary:

The experimental pKa value for test chemical was determine to be 0.0000000000000237(0.23 x 10-13) at 30 degC indicating that it has dissociation properties.

Description of key information

The experimental pKa value for test chemical was determine to be 0.0000000000000237(0.23 x 10-13) at 30 degC indicating that it has dissociation properties.

Key value for chemical safety assessment

pKa at 20°C:
0

Additional information

The experimental pKa value for test chemical was determine to be 0.0000000000000237(0.23 x 10-13) at 30 degC indicating that it has dissociation properties.