3-(2,4-Dimethylphenyl)-6-ethoxy-1,3,5-triazine-2,4(1H,3H)-dione
Basic information
- CAS
63308-69-0- Standard SMILES
CCOc1nc(=O)n(-c2ccc(C)cc2C)c(=O)[nH]1- InChIKey
HLLGYLPVAQYLDU-UHFFFAOYSA-N- Molecular formula
- C13H15N3O3
- Average molar mass
- 261.28 g/mol
- Monoisotopic mass
- 261.11134135
Names & identifiers
- Preferred name
- 3-(2,4-Dimethylphenyl)-6-ethoxy-1,3,5-triazine-2,4(1H,3H)-dione
- IUPAC
- 3-(2,4-dimethylphenyl)-6-ethoxy-1H-1,3,5-triazine-2,4-dione
Names & synonyms
63308-69-03-(2,4-Dimethylphenyl)-6-ethoxy-1,3,5-triazine-2,4(1H,3H)-dioneSCHEMBL11391681DTXSID30530608
Database identifiers
- CAS
63308-69-0- PubChem CID
- 13233166
- DTXSID
DTXSID30530608
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 71 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 408
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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