2-(3-Nitrophenyl)-4,6-diphenyl-1,3,5-triazine
Basic information
- CAS
7753-05-1- Standard SMILES
O=[N+]([O-])c1cccc(-c2nc(-c3ccccc3)nc(-c3ccccc3)n2)c1- InChIKey
MPVJHWOGTWPIIR-UHFFFAOYSA-N- Molecular formula
- C21H14N4O2
- Average molar mass
- 354.4 g/mol
- Monoisotopic mass
- 354.1116757
Names & identifiers
- Preferred name
- 2-(3-Nitrophenyl)-4,6-diphenyl-1,3,5-triazine
- IUPAC
- 2-(3-nitrophenyl)-4,6-diphenyl-1,3,5-triazine
Names & synonyms
2-(3-nitrophenyl)-4,6-diphenyl-1,3,5-triazineDTXSID002747697753-05-1RefChem:251700DTXCID40226227ChemDiv1_000562Oprea1_203903Oprea1_246633SCHEMBL18409235HMS588J12AKOS000573758EU-0034926
Show more names
ST502184256-(3-nitrophenyl)-2,4-diphenyl-1,3,5-triazineSR-01000401257SR-01000401257-1
Database identifiers
- CAS
7753-05-1- PubChem CID
- 24431
- DTXSID
DTXSID00274769- Nikkaji
- J1.556.104A
Properties
Computed structural properties
- XLogP
- 5.3
- Topological polar surface area
- 84.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 459
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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