| CAS Number | 160376-74-9 |
| Catalog Number | AG01DTF5 |
| Chemical Name | (2-Phenylpyrrolidin-2-yl)methanol |
| IUPAC Name | (2-phenylpyrrolidin-2-yl)methanol |
| InChI | InChI=1S/C11H15NO/c13-9-11(7-4-8-12-11)10-5-2-1-3-6-10/h1-3,5-6,12-13H,4,7-9H2 |
| InChI Key | CKMDMLWSEWIBLU-UHFFFAOYSA-N |
| MDL Number | MFCD20684355 |
| Molecular Formula | C11H15NO |
| Molecular Weight | 177.2429 |
| SMILES | OCC1(C2=CC=CC=C2)NCCC1 |
| Synonyms | (2-phenylpyrrolidin-2-yl)methanol,
160376-74-9,
2-phenyl-2-Pyrrolidinemethanol,
SCHEMBL1247264,
AKOS034131888,
FT-0756810,
|
| Complexity | 166 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 177.115g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 177.247g/mol |
| Monoisotopic Mass | 177.115g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 32.3A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1 |
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Certificate of Analysis
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