| CAS Number | 1581610-58-3 |
| Catalog Number | AG01BUTF |
| Chemical Name | 3-amino-N-[(4-methoxyphenyl)methyl]propanamide hydrochloride |
| IUPAC Name | 3-amino-N-[(4-methoxyphenyl)methyl]propanamide;hydrochloride |
| InChI | InChI=1S/C11H16N2O2.ClH/c1-15-10-4-2-9(3-5-10)8-13-11(14)6-7-12;/h2-5H,6-8,12H2,1H3,(H,13,14);1H |
| InChI Key | HNXRYQQHCCZNFV-UHFFFAOYSA-N |
| MDL Number | MFCD30345396 |
| Molecular Formula | C11H17ClN2O2 |
| Molecular Weight | 244.7179 |
| SMILES | Cl.COC1=CC=C(CNC(CCN)=O)C=C1 |
| Synonyms | 3-amino-N-[(4-methoxyphenyl)methyl]propanamide hydrochloride,
1581610-58-3,
AKOS025563840,
|
| Complexity | 189 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 244.098g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 244.719g/mol |
| Monoisotopic Mass | 244.098g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 64.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number