2-Butyl-4,6-dimethyl-1,3,5-triazine
Basic information
- CAS
30362-05-1- Standard SMILES
CCCCc1nc(C)nc(C)n1- InChIKey
BUJKXAFVOPGHTB-UHFFFAOYSA-N- Molecular formula
- C9H15N3
- Average molar mass
- 165.24 g/mol
- Monoisotopic mass
- 165.12659749
Names & identifiers
- Preferred name
- 2-Butyl-4,6-dimethyl-1,3,5-triazine
- IUPAC
- 2-butyl-4,6-dimethyl-1,3,5-triazine
Names & synonyms
2-butyl-4,6-dimethyl-1,3,5-triazine30362-05-1DTXSID402752302-butyl-4,6-dimethyl-[1,3,5]triazine
Database identifiers
- CAS
30362-05-1- PubChem CID
- 35160
- DTXSID
DTXSID40275230- Nikkaji
- J1.613.690E
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 38.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 117
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Compound notes
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