| CAS Number | 152535-13-2 |
| Catalog Number | AG01A1A3 |
| Chemical Name | N-(2-aminoethyl)-2-fluorobenzamide hydrochloride |
| IUPAC Name | N-(2-aminoethyl)-2-fluorobenzamide;hydrochloride |
| InChI | InChI=1S/C9H11FN2O.ClH/c10-8-4-2-1-3-7(8)9(13)12-6-5-11;/h1-4H,5-6,11H2,(H,12,13);1H |
| InChI Key | IGTRQMOEEGQYCB-UHFFFAOYSA-N |
| MDL Number | MFCD22392227 |
| Molecular Formula | C9H12ClFN2O |
| Molecular Weight | 218.6558 |
| SMILES | Cl.NCCNC(C1=C(F)C=CC=C1)=O |
| Synonyms | N-(2-aminoethyl)-2-fluorobenzamide hydrochloride,
152535-13-2,
|
| Complexity | 175 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 218.062g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 218.656g/mol |
| Monoisotopic Mass | 218.062g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 55.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
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