Basic information
- CAS
13704-97-7- Standard SMILES
CCc1nc(Cl)nc(-c2ccccc2)n1- InChIKey
UPVKICPNUOSADG-UHFFFAOYSA-N- Molecular formula
- C11H10ClN3
- Average molar mass
- 219.67 g/mol
- Monoisotopic mass
- 219.056325
Names & identifiers
- Preferred name
- 2-Chloro-4-ethyl-6-phenyl-1,3,5-triazine
- IUPAC
- 2-chloro-4-ethyl-6-phenyl-1,3,5-triazine
Names & synonyms
2-chloro-4-ethyl-6-phenyl-1,3,5-triazine13704-97-7DTXSID40274804RefChem:258737DTXCID40226262SCHEMBL7523521
Database identifiers
- CAS
13704-97-7- PubChem CID
- 26201
- DTXSID
DTXSID40274804- Nikkaji
- J1.556.341I
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 38.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 194
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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