Oxpheneridine
Basic information
- CAS
546-32-7- Standard SMILES
CCOC(=O)C1(c2ccccc2)CCN(CC(O)c2ccccc2)CC1- InChIKey
DBDXZFAMJLGFGD-UHFFFAOYSA-N- Molecular formula
- C22H27NO3
- Average molar mass
- 353.5 g/mol
- Monoisotopic mass
- 353.19909372
Names & identifiers
- Preferred name
- Oxpheneridine
- IUPAC
- ethyl 1-(2-hydroxy-2-phenylethyl)-4-phenylpiperidine-4-carboxylate
- English name
- Oxpheneridine
- Molecular formula
- C22H27NO3
- Molecular weight
- 353.45
Names & synonyms
Oxpheneridine546-32-7ethyl 1-(2-hydroxy-2-phenylethyl)-4-phenylpiperidine-4-carboxylate5OO7RKH9WLOxpheneridinaOxpheneridinumUNII-5OO7RKH9WLOxpheneridine [INN:DCF]OxofeneridinaOXPHENERIDINE [INN]orb1740359SCHEMBL2110574
Show more names
1-(2-hydroxy-2-phenyl-ethyl)-4-phenyl-isonipecot ethyl esterethyl 1-(2-hydroxy-2-phenyl-ethyl)-4-phenyl-piperidine-4-carboxylate4-Piperidinecarboxylic acid, 1-(2-hydroxy-2-phenylethyl)-4-phenyl-, ethyl ester
CHEMBL2106540DTXSID80862163Ethyl 1-(beta-hydroxyphenethyl)-4-phenyl-4-piperidyl-carboxylat1-(beta-Hydroxyphenethyl)-4-phenylpiperidine-4-carboxylic acid ethyl esterNS00120919T69121Q71157621-(.BETA.-HYDROXYPHENETHYL)-4-PHENYLPIPERIDINE-4-CARBOXYLIC ACID ETHYL ESTER
Database identifiers
- CAS
546-32-7- PubChem CID
- 56863
- DTXSID
DTXSID80862163- ChEMBL
CHEMBL2106540- UNII
- 5OO7RKH9WL
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 49.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 433
Physicochemical properties
- Melting point
- 128.5 °C · 128.5 °C(Solv: ethanol (64-17-5))
- Boiling point
- 489.9 · 489.9±45.0 °C(Predicted)
- Density
- 1.137 · 1.137±0.06 g/cm3(Predicted)
- pka
- 14.19 · 14.19±0.20(Predicted)
- FDA UNII
- 5 OO7RKH9WL · 5OO7RKH9WL
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…