| CAS Number | 42276-10-8 |
| Catalog Number | AG019KPW |
| Chemical Name | 2-chloro-N-(2-methylbutan-2-yl)propanamide |
| IUPAC Name | 2-chloro-N-(2-methylbutan-2-yl)propanamide |
| InChI | InChI=1S/C8H16ClNO/c1-5-8(3,4)10-7(11)6(2)9/h6H,5H2,1-4H3,(H,10,11) |
| InChI Key | HPEFGDWNJFYURQ-UHFFFAOYSA-N |
| MDL Number | MFCD09930823 |
| Molecular Formula | C8H16ClNO |
| Molecular Weight | 177.6717 |
| SMILES | CCC(NC(C(Cl)C)=O)(C)C |
| Synonyms | 2-chloro-N-(2-methylbutan-2-yl)propanamide,
42276-10-8,
AC1Q2RYB,
CTK6C9151,
AKOS000171975,
NE14626,
EN300-27941,
|
| Complexity | 145 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 177.092g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 177.672g/mol |
| Monoisotopic Mass | 177.092g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 29.1A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number