| CAS Number | 86569-49-5 |
| Catalog Number | AG008FNX(AGN-PC-0WB3Y8) |
| Chemical Name | N-(2-Amino-4-chlorophenyl)-2-methylpropanamide |
| IUPAC Name | N-(2-amino-4-chlorophenyl)-2-methylpropanamide |
| InChI | InChI=1S/C10H13ClN2O/c1-6(2)10(14)13-9-4-3-7(11)5-8(9)12/h3-6H,12H2,1-2H3,(H,13,14) |
| InChI Key | YCXWEZUJLYFKCU-UHFFFAOYSA-N |
| MDL Number | MFCD09047734 |
| Molecular Formula | C10H13ClN2O |
| Molecular Weight | 212.6760 |
| SMILES | C(C(C)C)(=O)NC1=CC=C(C=C1N)Cl |
| Synonyms | N-(2-AMINO-4-CHLOROPHENYL)-2-METHYLPROPANAMIDE,
86569-49-5,
N-(2-Amino-4-chlorophenyl)isobutyramide,
CTK5F6961,
DTXSID30517656,
ZINC8732406,
MFCD09047734,
STL411756,
AKOS000102042,
MCULE-8912460387,
AJ-59154,
Y-4931,
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| 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 | 2.4 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number