| CAS Number | 1193388-96-3 |
| Catalog Number | AG019VRM(AGN-PC-07HC4M) |
| Chemical Name | 4-amino-2-chloro-N-(2-methylbutan-2-yl)benzamide hydrochloride |
| IUPAC Name | 4-amino-2-chloro-N-(2-methylbutan-2-yl)benzamide;hydrochloride |
| InChI | InChI=1S/C12H17ClN2O.ClH/c1-4-12(2,3)15-11(16)9-6-5-8(14)7-10(9)13;/h5-7H,4,14H2,1-3H3,(H,15,16);1H |
| InChI Key | KWSJEJSHWOSAAN-UHFFFAOYSA-N |
| MDL Number | MFCD12197230 |
| Molecular Formula | C12H18Cl2N2O |
| Molecular Weight | 277.1901 |
| SMILES | Cl.CCC(NC(C1=C(Cl)C=C(N)C=C1)=O)(C)C |
| Synonyms | 4-amino-2-chloro-N-(2-methylbutan-2-yl)benzamide hydrochloride,
1193388-96-3,
AC1Q39LU,
CTK6C9205,
AKOS026852210,
MCULE-7286647490,
NE15494,
EN300-48604,
J-004105,
|
| Complexity | 255 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 276.08g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 277.189g/mol |
| Monoisotopic Mass | 276.08g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 55.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number