Registration Dossier

Administrative data

Endpoint:
dissociation constant
Type of information:
experimental study
Adequacy of study:
weight of evidence
Reliability:
2 (reliable with restrictions)
Rationale for reliability incl. deficiencies:
other: Authoritative secondary source

Data source

Reference
Reference Type:
secondary source
Title:
Reaxys ID 969468
Author:
Reaxys
Year:
2015
Bibliographic source:
Copyright © 2015 Reed Elsevier Properties SA. All rights reserved. Authorized use only. Reaxys® and the Reaxys® trademark are owned and protected by Reed Elsevier Properties SA and used under license.
Report date:
2015

Materials and methods

Test guideline
Guideline:
other: no data
GLP compliance:
not specified

Test material

Constituent 1
Chemical structure
Reference substance name:
(diethylamino)acetonitrile
EC Number:
221-130-6
EC Name:
(diethylamino)acetonitrile
Cas Number:
3010-02-4
Molecular formula:
C6H12N2
IUPAC Name:
2-(diethylamino)acetonitrile
Details on test material:
- Name of test material (as cited in study report): 2-(diethylamino)acetonitrile
- Analytical purity: pure

Results and discussion

Dissociating properties:
yes
Dissociation constantopen allclose all
pKa:
4.55
Temp.:
25 °C
Remarks on result:
other: potentiometric; Kreevoy,M.M.; Oh,S.-W.; Journal of the American Chemical Society; vol. 95; (1973); p. 4805 - 4810,
pKa:
4.55
Temp.:
25 °C
Remarks on result:
other: potentiometric; Stevenson; Williamson; Journal of the American Chemical Society; vol. 80; (1958); p. 5943,5946
pKa:
4.5
Temp.:
29 °C
Remarks on result:
other: potentiometric; Soloway; Lipschitz; Journal of Organic Chemistry; vol. 23; (1958); p. 613
pKa:
4
Remarks on result:
other: potentiometric; Stewart; Cook; Journal of the American Chemical Society; vol. 50; (1928); p. 1980

Applicant's summary and conclusion