| CAS Number | 1334492-35-1 |
| Catalog Number | AG01BJDD |
| Chemical Name | 2-(1-phenylethyl)pyrrolidine |
| IUPAC Name | 2-(1-phenylethyl)pyrrolidine |
| InChI | InChI=1S/C12H17N/c1-10(12-8-5-9-13-12)11-6-3-2-4-7-11/h2-4,6-7,10,12-13H,5,8-9H2,1H3 |
| InChI Key | CGEFMKSWZUCNDG-UHFFFAOYSA-N |
| MDL Number | MFCD20232547 |
| Molecular Formula | C12H17N |
| Molecular Weight | 175.2701 |
| SMILES | CC(C1=CC=CC=C1)C1NCCC1 |
| Synonyms | 2-(1-phenylethyl)pyrrolidine,
1334492-35-1,
2-(1-Phenyl-ethyl)-pyrrolidine,
|
| Complexity | 149 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 175.136g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 175.275g/mol |
| Monoisotopic Mass | 175.136g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 12A^2 |
| Undefined Atom Stereocenter Count | 2 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.6 |
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