| CAS Number | 83596-49-0 |
| Catalog Number | AG019VAS |
| Chemical Name | 2-amino-4-chloro-N-(propan-2-yl)benzamide |
| IUPAC Name | 2-amino-4-chloro-N-propan-2-ylbenzamide |
| InChI | InChI=1S/C10H13ClN2O/c1-6(2)13-10(14)8-4-3-7(11)5-9(8)12/h3-6H,12H2,1-2H3,(H,13,14) |
| InChI Key | DDUFHCYDQKMFQD-UHFFFAOYSA-N |
| MDL Number | MFCD09046634 |
| Molecular Formula | C10H13ClN2O |
| Molecular Weight | 212.6760 |
| SMILES | CC(NC(C1=C(N)C=C(Cl)C=C1)=O)C |
| Synonyms | 2-amino-4-chloro-N-(propan-2-yl)benzamide,
83596-49-0,
AC1Q1Q64,
SCHEMBL11134938,
CTK6A9894,
ZINC20156115,
AKOS000130227,
MCULE-5549193385,
NE17861,
EN300-44269,
|
| Complexity | 208 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 212.072g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 212.677g/mol |
| Monoisotopic Mass | 212.072g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 55.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number