| CAS Number | 39096-40-7 |
| Catalog Number | AG019VO4(AGN-PC-0DNZ3J) |
| Chemical Name | 2-chloro-N-(2-methylpropyl)-N-(propan-2-yl)acetamide |
| IUPAC Name | 2-chloro-N-(2-methylpropyl)-N-propan-2-ylacetamide |
| InChI | InChI=1S/C9H18ClNO/c1-7(2)6-11(8(3)4)9(12)5-10/h7-8H,5-6H2,1-4H3 |
| InChI Key | NSOZCRVCADMVSW-UHFFFAOYSA-N |
| MDL Number | MFCD12798905 |
| Molecular Formula | C9H18ClNO |
| Molecular Weight | 191.6983 |
| SMILES | CC(CN(C(CCl)=O)C(C)C)C |
| Synonyms | 2-chloro-N-(2-methylpropyl)-N-(propan-2-yl)acetamide,
39096-40-7,
ZINC37654161,
AKOS010026353,
NE45525,
2-chloro-N-isobutyl-N-isopropylacetamide,
|
| Complexity | 146 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 191.108g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 191.699g/mol |
| Monoisotopic Mass | 191.108g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 20.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.5 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number