Ethyl 2-cyano-3,3-diphenylpentanoate
Basic information
- CAS
55417-52-2- Standard SMILES
CCOC(=O)C(C#N)C(CC)(c1ccccc1)c1ccccc1- InChIKey
ZSUDSIFYBDBEED-UHFFFAOYSA-N- Molecular formula
- C20H21NO2
- Average molar mass
- 307.4 g/mol
- Monoisotopic mass
- 307.15722891
Names & identifiers
- Preferred name
- Ethyl 2-cyano-3,3-diphenylpentanoate
- IUPAC
- ethyl 2-cyano-3,3-diphenylpentanoate
Names & synonyms
ethyl 2-cyano-3,3-diphenylpentanoate55417-52-2NCIOpen2_009119DTXSID40292523
Database identifiers
- CAS
55417-52-2- PubChem CID
- 256504
- DTXSID
DTXSID40292523
Properties
Computed structural properties
- XLogP
- 4.9
- Topological polar surface area
- 50.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 7
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 406
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…