Basic information
- CAS
30805-33-5- Standard SMILES
CC1NC(=O)NC(C)N1- InChIKey
WXLKCKRVBKSTAW-UHFFFAOYSA-N- Molecular formula
- C5H11N3O
- Average molar mass
- 129.16 g/mol
- Monoisotopic mass
- 129.09021198
Names & identifiers
- Preferred name
- 4,6-Dimethyl-1,3,5-triazinan-2-one
- IUPAC
- 4,6-dimethyl-1,3,5-triazinan-2-one
Names & synonyms
30805-33-54,6-dimethyl-1,3,5-triazinan-2-oneDTXSID60275313AKOS006347306
Database identifiers
- CAS
30805-33-5- PubChem CID
- 35518
- DTXSID
DTXSID60275313- Nikkaji
- J1.615.056H
Properties
Computed structural properties
- XLogP
- -0.2
- Topological polar surface area
- 53.2 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 113
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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