| CAS Number | 1607781-85-0 |
| Catalog Number | AG01B8T3 |
| Chemical Name | N-(3-Aminopropyl)-3-phenylprop-2-enamide hydrochloride |
| IUPAC Name | N-(3-aminopropyl)-3-phenylprop-2-enamide;hydrochloride |
| InChI | InChI=1S/C12H16N2O.ClH/c13-9-4-10-14-12(15)8-7-11-5-2-1-3-6-11;/h1-3,5-8H,4,9-10,13H2,(H,14,15);1H |
| InChI Key | OAMXFTJVRYXPOY-UHFFFAOYSA-N |
| MDL Number | MFCD28348113 |
| Molecular Formula | C12H17ClN2O |
| Molecular Weight | 240.7292 |
| SMILES | Cl.NCCCNC(C=CC1=CC=CC=C1)=O |
| Synonyms | N-(3-aminopropyl)-3-phenylprop-2-enamide hydrochloride,
1607781-85-0,
|
| Complexity | 208 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 240.103g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 240.731g/mol |
| Monoisotopic Mass | 240.103g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 55.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 1 |
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Certificate of Analysis
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