Registration Dossier
Registration Dossier
Please be aware that this old REACH registration data factsheet is no longer maintained; it remains frozen as of 19th May 2023.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.
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EC number: 201-182-6 | CAS number: 79-16-3
Dissociation constant
Administrative data
- Endpoint:
- dissociation constant
- Type of information:
- calculation (if not (Q)SAR)
- Remarks:
- Migrated phrase: estimated by calculation
- Adequacy of study:
- supporting study
- Reliability:
- 2 (reliable with restrictions)
- Rationale for reliability incl. deficiencies:
- other: accepted calculation method
Data source
Reference
- Reference Type:
- other: calculated
- Title:
- N-methylamide
- Author:
- BASF
- Year:
- 2 009
- Bibliographic source:
- BASF SE, Department of Product Safety,SPARC online calculator, v4.5
Materials and methods
Test guideline
- Guideline:
- other: calculated
- GLP compliance:
- no
Test material
- Reference substance name:
- N-methylacetamide
- EC Number:
- 201-182-6
- EC Name:
- N-methylacetamide
- Cas Number:
- 79-16-3
- Molecular formula:
- C3H7NO
- IUPAC Name:
- N-methylacetamide
- Details on test material:
- - Name of test material (as cited in study report): N-methylacetamide
- Analytical purity: pure
Constituent 1
Results and discussion
- Dissociating properties:
- no
Dissociation constantopen allclose all
- pKa:
- -0.11
- Temp.:
- 25 °C
- Remarks on result:
- other: calculated NH2-group
- pKa:
- -0.46
- Temp.:
- 25 °C
- Remarks on result:
- other: IUPAC/Perrin: NH2-group
- pKa:
- -3.55
- Temp.:
- 25 °C
- Remarks on result:
- other: calculated O-group
- pKa:
- -3.7
- Temp.:
- 25 °C
- Remarks on result:
- other: IUPAC/Perrin: O-group
Any other information on results incl. tables
calculated pKa will tend not to dissociate in water under normal enviromental conditions, because of pKa is smaller than the environmentally relevant pH range (5-9).
Applicant's summary and conclusion
Information on Registered Substances comes from registration dossiers which have been assigned a registration number. The assignment of a registration number does however not guarantee that the information in the dossier is correct or that the dossier is compliant with Regulation (EC) No 1907/2006 (the REACH Regulation). This information has not been reviewed or verified by the Agency or any other authority. The content is subject to change without prior notice.
Reproduction or further distribution of this information may be subject to copyright protection. Use of the information without obtaining the permission from the owner(s) of the respective information might violate the rights of the owner.
