Basic information
- CAS
10081-17-1- Standard SMILES
COc1ccc(CC(C(=O)OC2CCN3CCC2CC3)c2ccccc2)cc1- InChIKey
VIXGTXFTNHFKGC-UHFFFAOYSA-N- Molecular formula
- C24H29NO3
- Average molar mass
- 379.5 g/mol
- Monoisotopic mass
- 379.21474379
Names & identifiers
- Preferred name
- Propionic acid, 3-(p-methoxyphenyl)-2-phenyl-, 1-azabicyclo(3.2.2)non-4-yl ester
- IUPAC
- 1-azabicyclo[3.2.2]nonan-4-yl 3-(4-methoxyphenyl)-2-phenylpropanoate
Names & synonyms
3-(p-Methoxyphenyl)-2-phenylpropionic acid 1-azabicyclo(3.2.2)non-4-yl ester10081-17-1Propionic acid, 3-(p-methoxyphenyl)-2-phenyl-, 1-azabicyclo(3.2.2)non-4-yl esterRefChem:375229DTXSID309057511-azabicyclo[3.2.2]nonan-4-yl 3-(4-methoxyphenyl)-2-phenylpropanoate
Database identifiers
- CAS
10081-17-1- PubChem CID
- 202292
- DTXSID
DTXSID30905751
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 38.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 488
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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