[1-[(E)-3-phenylprop-2-enyl]piperidin-3-yl] 2-hydroxy-2,2-diphenylacetate
Basic information
- CAS
18948-04-4- Standard SMILES
O=C(OC1CCCN(C/C=C/c2ccccc2)C1)C(O)(c1ccccc1)c1ccccc1- InChIKey
PGZLDLPELYXORR-GXDHUFHOSA-N- Molecular formula
- C28H29NO3
- Average molar mass
- 427.5 g/mol
- Monoisotopic mass
- 427.21474379
Names & identifiers
- Preferred name
- [1-[(E)-3-phenylprop-2-enyl]piperidin-3-yl] 2-hydroxy-2,2-diphenylacetate
- IUPAC
- [1-[(E)-3-phenylprop-2-enyl]piperidin-3-yl] 2-hydroxy-2,2-diphenylacetate
Names & synonyms
18948-04-4NSC130968NSC-130968
Database identifiers
- CAS
18948-04-4- PubChem CID
- 5833552
Properties
Computed structural properties
- XLogP
- 5.4
- Topological polar surface area
- 49.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 8
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 582
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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