| CAS Number | 307952-16-5 |
| Catalog Number | AG00I5S4(AGN-PC-01VT53) |
| Chemical Name | 1-(4-fluoro-2-methylphenyl)piperazine |
| IUPAC Name | 1-(4-fluoro-2-methylphenyl)piperazine |
| InChI | InChI=1S/C11H15FN2/c1-9-8-10(12)2-3-11(9)14-6-4-13-5-7-14/h2-3,8,13H,4-7H2,1H3 |
| InChI Key | QBLQGSYVHVJZKI-UHFFFAOYSA-N |
| MDL Number | MFCD09027434 |
| Molecular Formula | C11H15FN2 |
| Molecular Weight | 194.2486 |
| SMILES | CC1=C(N2CCNCC2)C=CC(F)=C1 |
| Synonyms | 1-(4-Fluoro-2-methylphenyl)piperazine,
307952-16-5,
Piperazine, 1-(4-fluoro-2-methylphenyl)-,
SCHEMBL706971,
QBLQGSYVHVJZKI-UHFFFAOYSA-N,
MFCD09027434,
ZINC37483266,
AKOS010081331,
1-(4-fluoro-2-methylphenyl)-piperazine,
AS-54927,
CS-0035875,
|
| Complexity | 180 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 194.122g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 194.253g/mol |
| Monoisotopic Mass | 194.122g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 15.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number