| CAS Number | 1784485-55-7 |
| Catalog Number | AG01B4SN |
| Chemical Name | 4-(3-fluorophenyl)-4-(hydroxymethyl)pyrrolidin-2-one |
| IUPAC Name | 4-(3-fluorophenyl)-4-(hydroxymethyl)pyrrolidin-2-one |
| InChI | InChI=1S/C11H12FNO2/c12-9-3-1-2-8(4-9)11(7-14)5-10(15)13-6-11/h1-4,14H,5-7H2,(H,13,15) |
| InChI Key | ANATXLHNPHKWLU-UHFFFAOYSA-N |
| MDL Number | MFCD29991781 |
| Molecular Formula | C11H12FNO2 |
| Molecular Weight | 209.2169 |
| SMILES | OCC1(C2=CC(F)=CC=C2)CC(=O)NC1 |
| Synonyms | 4-(3-fluorophenyl)-4-(hydroxymethyl)pyrrolidin-2-one,
1784485-55-7,
|
| Complexity | 259 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 209.085g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 209.22g/mol |
| Monoisotopic Mass | 209.085g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 49.3A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.4 |
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Certificate of Analysis
Lot Number