| CAS Number | 85606-96-8 |
| Catalog Number | AG00513U(AGN-PC-00KZOE) |
| Chemical Name | 3-(4-Fluorophenyl)piperazin-2-one |
| IUPAC Name | 3-(4-fluorophenyl)piperazin-2-one |
| InChI | InChI=1S/C10H11FN2O/c11-8-3-1-7(2-4-8)9-10(14)13-6-5-12-9/h1-4,9,12H,5-6H2,(H,13,14) |
| InChI Key | WAKCIILEYAIXOR-UHFFFAOYSA-N |
| MDL Number | MFCD07373576 |
| Molecular Formula | C10H11FN2O |
| Molecular Weight | 194.2055 |
| SMILES | C1(=O)NCCNC1C1=CC=C(C=C1)F |
| Synonyms | 3-(4-FLUOROPHENYL)PIPERAZIN-2-ONE,
85606-96-8,
3-(4-FLUORO-PHENYL)-PIPERAZIN-2-ONE,
SCHEMBL380027,
CTK5F5327,
DTXSID00519485,
WAKCIILEYAIXOR-UHFFFAOYSA-N,
piperazinone,3-(4-fluorophenyl)-,
3-(4-Fluorophenyl)-2-oxopiperazine,
MFCD07373576,
3-(4-fluorophenyl)-piperazin-2-one,
AKOS011636563,
AB37441,
MCULE-2869605797,
NS-01884,
3-(4-FLUOROPHENYL)-2-PIPERAZINONE,
BB 0258934,
Y-2861,
137684-16-3,
2-(2-methyl-1H-imidazol-1-yl)ethanamine,
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| Complexity | 214 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 194.086g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 194.209g/mol |
| Monoisotopic Mass | 194.086g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 41.1A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.7 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number