| CAS Number | 1251924-84-1 |
| Catalog Number | AG01A9W4 |
| Chemical Name | 3-amino-N-(2-chloro-4-methylphenyl)propanamide hydrochloride |
| IUPAC Name | 3-amino-N-(2-chloro-4-methylphenyl)propanamide;hydrochloride |
| InChI | InChI=1S/C10H13ClN2O.ClH/c1-7-2-3-9(8(11)6-7)13-10(14)4-5-12;/h2-3,6H,4-5,12H2,1H3,(H,13,14);1H |
| InChI Key | ANFJWQDUSCZMOE-UHFFFAOYSA-N |
| MDL Number | MFCD16817466 |
| Molecular Formula | C10H14Cl2N2O |
| Molecular Weight | 249.1370 |
| SMILES | Cl.CC1=CC(Cl)=C(NC(CCN)=O)C=C1 |
| Synonyms | 3-amino-N-(2-chloro-4-methylphenyl)propanamide hydrochloride,
1251924-84-1,
AC1Q39F2,
AKOS025440221,
NE42920,
EN300-66341,
|
| Complexity | 199 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 248.048g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 249.135g/mol |
| Monoisotopic Mass | 248.048g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 55.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
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