| CAS Number | 150783-39-4 |
| Catalog Number | AG01AN2S(AGN-PC-0LA73Q) |
| Chemical Name | N-(4-Chloro-2-nitrophenyl)pivalamide |
| IUPAC Name | N-(4-chloro-2-nitrophenyl)-2,2-dimethylpropanamide |
| InChI | InChI=1S/C11H13ClN2O3/c1-11(2,3)10(15)13-8-5-4-7(12)6-9(8)14(16)17/h4-6H,1-3H3,(H,13,15) |
| InChI Key | IOGMTRJJIWRGJR-UHFFFAOYSA-N |
| MDL Number | MFCD00095904 |
| Molecular Formula | C11H13ClN2O3 |
| Molecular Weight | 256.6855 |
| SMILES | CC(C(NC1=C([N+]([O-])=O)C=C(Cl)C=C1)=O)(C)C |
| Synonyms | N-(4-chloro-2-nitrophenyl)-2,2-dimethylpropanamide,
150783-39-4,
N-(4-Chloro-2-nitrophenyl)pivalamide,
AC1N9EUP,
AC1Q1LMC,
ZINC4828644,
AKOS002961042,
MCULE-5573847832,
CID4384446,
4'-chloro-2,2-dimethyl-2'-nitropropionanilide,
N-(4-chloro-2-nitro-phenyl)-2,2-dimethyl-propanamide,
|
| Complexity | 309 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 256.061g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 256.686g/mol |
| Monoisotopic Mass | 256.061g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 74.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number