| CAS Number | 77775-70-3 |
| Catalog Number | AG00J3KD |
| Chemical Name | N-(3,5-dimethoxybenzyl)-2-phenylethanamine hydrochloride |
| IUPAC Name | N-[(3,5-dimethoxyphenyl)methyl]-2-phenylethanamine;hydrochloride |
| InChI | InChI=1S/C17H21NO2.ClH/c1-19-16-10-15(11-17(12-16)20-2)13-18-9-8-14-6-4-3-5-7-14;/h3-7,10-12,18H,8-9,13H2,1-2H3;1H |
| InChI Key | HRXDYZGSXQKGDD-UHFFFAOYSA-N |
| MDL Number | MFCD13186283 |
| Molecular Formula | C17H22ClNO2 |
| Molecular Weight | 307.8151 |
| SMILES | C1C(OC)=CC(=CC=1OC)CNCCC1=CC=CC=C1.Cl |
| Synonyms | N-(3,5-Dimethoxybenzyl)-2-phenylethanamine hydrochloride,
77775-70-3,
ZX-CM015715,
MFCD13186283,
345221-52-5,
|
| Complexity | 241 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 307.134g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 21 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 307.818g/mol |
| Monoisotopic Mass | 307.134g/mol |
| Rotatable Bond Count | 7 |
| Topological Polar Surface Area | 30.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number