| CAS Number | 194943-60-7 |
| Catalog Number | AG019Y06(AGN-PC-0160HW) |
| Chemical Name | 2-(2-Fluorophenyl)-1-(piperazin-1-yl)ethan-1-one |
| IUPAC Name | 2-(2-fluorophenyl)-1-piperazin-1-ylethanone |
| InChI | InChI=1S/C12H15FN2O/c13-11-4-2-1-3-10(11)9-12(16)15-7-5-14-6-8-15/h1-4,14H,5-9H2 |
| InChI Key | RQSLRWFUPHONSA-UHFFFAOYSA-N |
| MDL Number | MFCD09729199 |
| Molecular Formula | C12H15FN2O |
| Molecular Weight | 222.2587 |
| SMILES | FC1=C(CC(N2CCNCC2)=O)C=CC=C1 |
| Synonyms | 2-(2-fluorophenyl)-1-(piperazin-1-yl)ethan-1-one,
194943-60-7,
AC1Q4L4M,
SCHEMBL8665194,
CTK7G3525,
STL483230,
ZINC22166630,
1-[(2-Fluorophenyl)acetyl]piperazine,
AKOS000138176,
MCULE-4137998399,
NE25910,
EN300-56539,
2-(2-fluorophenyl)-1-(piperazin-1-yl)ethanone,
A1-06562,
|
| Complexity | 241 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 222.117g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 222.263g/mol |
| Monoisotopic Mass | 222.117g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 32.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.8 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number