5,5,6,6-tetraethoxy-2,4-diphenyl-4H-pyran-3-carbonitrile
Basic information
- CAS
56069-63-7- Standard SMILES
CCOC1(OCC)OC(c2ccccc2)=C(C#N)C(c2ccccc2)C1(OCC)OCC- InChIKey
HFLTWLVSNNAADZ-UHFFFAOYSA-N- Molecular formula
- C26H31NO5
- Average molar mass
- 437.5 g/mol
- Monoisotopic mass
- 437.22022309
Names & identifiers
- Preferred name
- 5,5,6,6-tetraethoxy-2,4-diphenyl-4H-pyran-3-carbonitrile
- IUPAC
- 5,5,6,6-tetraethoxy-2,4-diphenyl-4H-pyran-3-carbonitrile
Names & synonyms
56069-63-75,5,6,6-tetraethoxy-2,4-diphenyl-4H-pyran-3-carbonitrileAG-650/410692212H-Pyran-5-carbonitrile, 2,2,3,3-tetraethoxy-3,4-dihydro-4,6-diphenyl-2,2,3,3-tetraethoxy-4,6-diphenyl-3,4-dihydro-2H-pyran-5-carbonitrileDTXSID60399745
Database identifiers
- CAS
56069-63-7- PubChem CID
- 4135983
- DTXSID
DTXSID60399745
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 69.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 10
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 657
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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