Basic information
- CAS
63905-82-8- Standard SMILES
CC1CCCCN1CCCOC(=O)C(c1ccccc1)c1ccccc1- InChIKey
RJUUDPCLWNXKQZ-UHFFFAOYSA-N- Molecular formula
- C23H29NO2
- Average molar mass
- 351.5 g/mol
- Monoisotopic mass
- 351.21982917
Names & identifiers
- Preferred name
- 3-(2-Methylpiperidin-1-yl)propyl diphenylacetate
- IUPAC
- 3-(2-methylpiperidin-1-yl)propyl 2,2-diphenylacetate
- English name
- Diphenylacetic acid 3-(2-methylpiperidino)propyl ester
- Molecular formula
- C23H29NO2
- Molecular weight
- 351.48
Names & synonyms
63905-82-8DTXSID609808993-(2-Methylpiperidin-1-yl)propyl diphenylacetateRefChem:1066599DTXCID2014081723-(2'-Methylpiperidino)propyl diphenylacetateACETIC ACID, DIPHENYL-, 3-(2'-METHYLPIPERIDINO)PROPYL ESTERDiphenylacetic acid 3-(2-methylpiperidino)propyl esterDB-307856Benzeneacetic acid, α-phenyl-, 3-(2-methyl-1-piperidinyl)propyl ester
Database identifiers
- CAS
63905-82-8- PubChem CID
- 45130
- DTXSID
DTXSID60980899- Nikkaji
- J86.187A
Properties
Computed structural properties
- XLogP
- 5.1
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 8
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 394
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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