3-Buten-2-one, 4-(2-furanyl)-1-(triphenylphosphoranylidene)-, (3E)-
Basic information
- CAS
923025-63-2- Standard SMILES
O=C(C=Cc1ccco1)C=P(c1ccccc1)(c1ccccc1)c1ccccc1- InChIKey
OKCXQYHUUSZDIP-UHFFFAOYSA-N- Molecular formula
- C26H21O2P
- Average molar mass
- 396.4 g/mol
- Monoisotopic mass
- 396.12791691
Names & identifiers
- Preferred name
- 3-Buten-2-one, 4-(2-furanyl)-1-(triphenylphosphoranylidene)-, (3E)-
- IUPAC
- 4-(furan-2-yl)-1-(triphenyl-λ5-phosphanylidene)but-3-en-2-one
Names & synonyms
923025-63-23-Buten-2-one, 4-(2-furanyl)-1-(triphenylphosphoranylidene)-, (3E)-4-(furan-2-yl)-1-(triphenyl-lambda5-phosphanylidene)but-3-en-2-oneDTXSID00408663AKOS0306949964-(Furan-2-yl)-1-(triphenyl-lambda~5~-phosphanylidene)but-3-en-2-one
Database identifiers
- CAS
923025-63-2- PubChem CID
- 5136155
- DTXSID
DTXSID00408663
Properties
Computed structural properties
- XLogP
- 4.8
- Topological polar surface area
- 30.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 6
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 552
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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