| CAS Number | 1258312-96-7 |
| Catalog Number | AG01FSG0(AGN-PC-3H604G) |
| Chemical Name | 2-(Benzylamino)-1-(4-methoxyphenyl)ethanone hydrochloride |
| IUPAC Name | 2-(benzylamino)-1-(4-methoxyphenyl)ethanone;hydrochloride |
| InChI | InChI=1S/C16H17NO2.ClH/c1-19-15-9-7-14(8-10-15)16(18)12-17-11-13-5-3-2-4-6-13;/h2-10,17H,11-12H2,1H3;1H |
| InChI Key | BFQWORIWOPEKEL-UHFFFAOYSA-N |
| MDL Number | MFCD30749357 |
| Molecular Formula | C16H18ClNO2 |
| Molecular Weight | 291.7726 |
| SMILES | COc1ccc(cc1)C(=O)CNCc1ccccc1.Cl |
| Synonyms | 2-(Benzylamino)-1-(4-methoxyphenyl)ethanone hydrochloride,
1258312-96-7,
KS-00000UB6,
DS-20153,
|
| Complexity | 266 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 291.102606g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 20 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 291.77g/mol |
| Monoisotopic Mass | 291.102606g/mol |
| Rotatable Bond Count | 6 |
| Topological Polar Surface Area | 38.3Ų |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number