Basic information
- CAS
1439-43-6- Standard SMILES
O=C(C=P(c1ccccc1)(c1ccccc1)c1ccccc1)c1ccc([N+](=O)[O-])cc1- InChIKey
DFJBEZQYRSJOSI-UHFFFAOYSA-N- Molecular formula
- C26H20NO3P
- Average molar mass
- 425.4 g/mol
- Monoisotopic mass
- 425.1180805
Names & identifiers
- Preferred name
- Acetophenone, 4'-nitro-2-(triphenylphosphoranylidene)-
- IUPAC
- 1-(4-nitrophenyl)-2-(triphenyl-λ5-phosphanylidene)ethanone
Names & synonyms
1439-43-6ACETOPHENONE, 4'-NITRO-2-(TRIPHENYLPHOSPHORANYLIDENE)-1-(4-Nitrophenyl)-2-(triphenylphosphoranylidene)ethanonep-NitroacetophenylenetriphenylphosphineBRN 05744754'-Nitro-2-(triphenylphosphoranylidene)acetophenoneNSC291933Ethanone, 1-(4-nitrophenyl)-2-(triphenylphosphoranylidene)-SCHEMBL4604180DTXSID20162573NSC 291933NSC-291933
Show more names
1-(4-Nitrophenyl)-2-(triphenyl-lambda~5~-phosphanylidene)ethan-1-one
Database identifiers
- CAS
1439-43-6- PubChem CID
- 15039
- DTXSID
DTXSID20162573- Nikkaji
- J90.780D
Properties
Computed structural properties
- XLogP
- 5.1
- Topological polar surface area
- 62.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 606
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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