Basic information
- CAS
30361-89-8- Standard SMILES
c1ccc(Cc2ncncn2)cc1- InChIKey
PNCKWHDODAETSN-UHFFFAOYSA-N- Molecular formula
- C10H9N3
- Average molar mass
- 171.2 g/mol
- Monoisotopic mass
- 171.0796473
Names & identifiers
- Preferred name
- 2-Benzyl-1,3,5-triazine
- IUPAC
- 2-benzyl-1,3,5-triazine
Names & synonyms
2-benzyl-1,3,5-triazine30361-89-8SCHEMBL2163588SCHEMBL8652020DTXSID70275223
Database identifiers
- CAS
30361-89-8- PubChem CID
- 35145
- DTXSID
DTXSID70275223- Nikkaji
- J1.613.654I
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 38.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 137
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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