Basic information
- CAS
41848-69-5- Standard SMILES
O=C(c1ccccc1)C(CC(C(=O)c1ccccc1)c1ccccc1)c1ccccc1- InChIKey
KPOYPXGVRAXXPN-UHFFFAOYSA-N- Molecular formula
- C29H24O2
- Average molar mass
- 404.5 g/mol
- Monoisotopic mass
- 404.17763
Names & identifiers
- Preferred name
- 1,2,4,5-Tetraphenyl-1,5-pentanedione
- IUPAC
- 1,2,4,5-tetraphenylpentane-1,5-dione
- English name
- 1,2,4,5-TETRAPHENYL-1,5-PENTANEDIONE
- Molecular formula
- C29H24O2
- Molecular weight
- 404.5
Names & synonyms
1,2,4,5-Tetraphenyl-1,5-pentanedione41848-69-5DTXSID70320343RefChem:214832DTXCID50271465KPOYPXGVRAXXPN-UHFFFAOYSA-N1,2,4,5-tetraphenylpentane-1,5-dioneNSC358253SCHEMBL7580361AKOS024405936NSC-3582531,5-Pentanedione, 1,2,4,5-tetraphenyl-
Database identifiers
- CAS
41848-69-5- PubChem CID
- 337945
- DTXSID
DTXSID70320343
Properties
Computed structural properties
- XLogP
- 6.6
- Topological polar surface area
- 34.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 8
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 507
Physicochemical properties
- Melting point
- 149 °C · 149 °C
- Boiling point
- 584.8 · 584.8±50.0 °C(Predicted)
- Density
- 1.146 · 1.146±0.06 g/cm3(Predicted)
Chemistry & industry
Suppliers2 total
西格玛奥德里奇（上海）贸易有限公司21-20338288 · [email protected]
SIGMAALDRICH—
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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