| CAS Number | 1385696-29-6 |
| Catalog Number | AG01BFN0(AGN-PC-0WOQLB) |
| Chemical Name | 4-(4-Fluorophenyl)oxan-4-amine hydrochloride |
| IUPAC Name | 4-(4-fluorophenyl)oxan-4-amine;hydrochloride |
| InChI | InChI=1S/C11H14FNO.ClH/c12-10-3-1-9(2-4-10)11(13)5-7-14-8-6-11;/h1-4H,5-8,13H2;1H |
| InChI Key | MZNWYPHDHWWAJT-UHFFFAOYSA-N |
| MDL Number | MFCD22418720 |
| Molecular Formula | C11H15ClFNO |
| Molecular Weight | 231.6943 |
| SMILES | C1=C(C=CC(=C1)F)C2(CCOCC2)N.Cl |
| Synonyms | 4-(4-Fluorophenyl)oxan-4-amine hydrochloride,
1385696-29-6,
4-(4-fluorophenyl)tetrahydro-2H-pyran-4-amine hydrochloride,
AKOS026741135,
KS-7452,
NE16931,
|
| Complexity | 184 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 231.083g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 231.695g/mol |
| Monoisotopic Mass | 231.083g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 35.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number