Registration Dossier

Administrative data

Endpoint:
dermal absorption, other
Remarks:
in silico
Type of information:
calculation (if not (Q)SAR)
Adequacy of study:
supporting study

Data source

Reference
Reference Type:
other: caculation
Title:
In Silico skin absorption model
Author:
Jie Shen, Lambros Kromidas, Terry Schultz, Sneha Bhatia
Bibliographic source:
An in silico skin absorption model for fragrance materials, Shen et al., 2014. Food and Chemical Toxicology 74 (2014) 164–176

Materials and methods

Test guideline
Qualifier:
no guideline followed

Test material

Constituent 1
Chemical structure
Reference substance name:
(-)-3,7-dimethyloct-6-en-1-ol
EC Number:
231-415-7
EC Name:
(-)-3,7-dimethyloct-6-en-1-ol
Cas Number:
7540-51-4
Molecular formula:
C10H20O
IUPAC Name:
(3S)-3,7-dimethyloct-6-en-1-ol

Results and discussion

Percutaneous absorption
Parameter:
other: Absorption based on calculated Jmax
Absorption:
<= 80 %

Any other information on results incl. tables

Calculated value Jmax = 45. 378

Absorption ≤ 80%

Applicant's summary and conclusion

Conclusions:
Calculated value Jmax = 45. 378
Absorption ≤ 80%
Executive summary:

Calculated value Jmax = 45. 378

Absorption ≤ 80%