Basic information
- CAS
3202-86-6- Standard SMILES
Oc1ccccc1-c1nc(-c2ccccc2)nc(-c2ccccc2)n1- InChIKey
FRSMLANYBOTORN-UHFFFAOYSA-N- Molecular formula
- C21H15N3O
- Average molar mass
- 325.4 g/mol
- Monoisotopic mass
- 325.12151211
Names & identifiers
- Preferred name
- 2-(4,6-Diphenyl-1,3,5-triazin-2-yl)phenol
- IUPAC
- 2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenol
- English name
- 2-(2-Hydroxyphenyl)-4,6-diphenyl-1,3,5-triazine
- Molecular formula
- C21H15N3O
- Molecular weight
- 325.36
Names & synonyms
2-(4,6-Diphenyl-1,3,5-triazin-2-yl)phenol3202-86-6RefChem:251794Oprea1_023678SCHEMBL296255SCHEMBL15477958SCHEMBL15477959SCHEMBL17653997SCHEMBL29481861FRSMLANYBOTORN-UHFFFAOYSA-NDTXSID301273255CCG-15550
Show more names
Phenol, 2-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-(2-Hydroxyphenyl)-4,6-diphenyl-1,3,5-triazine
AKOS0016033742,4-diphenyl-6-(2'-hydroxyphenyl)-s-triazineo-(4,6-Diphenyl-1,3,5-triazin-2-yl)phenol2-(4,6-Diphenyl-1,3,5-triazin-2-yl)phenol #
Database identifiers
- CAS
3202-86-6- PubChem CID
- 18552
- DTXSID
DTXSID301273255- Nikkaji
- J693.674A
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 58.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 380
Physicochemical properties
- Melting point
- 246 °C · 246 °C(Solv: acetic acid (64-19-7))
- Boiling point
- 579.3 · 579.3±52.0 °C(Predicted)
- Density
- 1.235 · 1.235±0.06 g/cm3(Predicted)
- pka
- 8.9 · 8.90±0.35(Predicted)
Chemistry & industry
Suppliers1 total
西格玛奥德里奇（上海）贸易有限公司21-20338288 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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