Basic information
- CAS
3188-69-0- Standard SMILES
CCC(=O)OC1(c2ccccc2)CCN(C)C1- InChIKey
HSCOGTOYLILNHR-UHFFFAOYSA-N- Molecular formula
- C14H19NO2
- Average molar mass
- 233.31 g/mol
- Monoisotopic mass
- 233.14157885
Names & identifiers
- Preferred name
- 1-Methyl-3-phenylpyrrolidin-3-yl propanoate
- IUPAC
- (1-methyl-3-phenylpyrrolidin-3-yl) propanoate
Names & synonyms
1-methyl-3-phenylpyrrolidin-3-yl propanoate3188-69-0DTXSID40953788RefChem:1055790DTXCID301381830BRN 14307381-Methyl-3-phenyl-3-pyrrolidinol propionate3-Pyrrolidinol, 1-methyl-3-phenyl-, propionate (ester)5-21-02-00334 (Beilstein Handbook Reference)1-methyl-3-phenyl-3-pyrrolidinyl propionate
Database identifiers
- CAS
3188-69-0- PubChem CID
- 201073
- DTXSID
DTXSID40953788- Nikkaji
- J107.069J
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 273
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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