| CAS Number | 1327645-29-3 |
| Catalog Number | AG01ARKM(AGN-PC-0WCO7I) |
| Chemical Name | ([5-(4-FLUOROPHENYL)ISOXAZOL-3-YL]METHYL)AMINE HYDROCHLORIDE |
| IUPAC Name | [5-(4-fluorophenyl)-1,2-oxazol-3-yl]methanamine;hydrochloride |
| InChI | InChI=1S/C10H9FN2O.ClH/c11-8-3-1-7(2-4-8)10-5-9(6-12)13-14-10;/h1-5H,6,12H2;1H |
| InChI Key | ZPLWNLJELZGOOC-UHFFFAOYSA-N |
| MDL Number | MFCD11519405 |
| Molecular Formula | C10H10ClFN2O |
| Molecular Weight | 228.6506 |
| SMILES | FC1=CC=C(C=C1)C2=CC(CN)=NO2.Cl |
| Synonyms | {[5-(4-Fluorophenyl)isoxazol-3-yl]methyl}amine hydrochloride,
1327645-29-3,
([5-(4-FLUOROPHENYL)ISOXAZOL-3-YL]METHYL)AMINE HYDROCHLORIDE,
AKOS022295672,
MCULE-1480726724,
L-3082,
F2162-0006,
[5-(4-fluorophenyl)-1,2-oxazol-3-yl]methanamine;hydrochloride,
N/A,
|
| Complexity | 183 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 228.047g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 228.651g/mol |
| Monoisotopic Mass | 228.047g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 52A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number