| CAS Number | 850020-75-6 |
| Catalog Number | AG019NZ2 |
| Chemical Name | 2-chloro-N-methyl-N-[(propylcarbamoyl)methyl]acetamide |
| IUPAC Name | 2-[(2-chloroacetyl)-methylamino]-N-propylacetamide |
| InChI | InChI=1S/C8H15ClN2O2/c1-3-4-10-7(12)6-11(2)8(13)5-9/h3-6H2,1-2H3,(H,10,12) |
| InChI Key | KFOSUFAEFLOCRS-UHFFFAOYSA-N |
| MDL Number | MFCD06384971 |
| Molecular Formula | C8H15ClN2O2 |
| Molecular Weight | 206.6699 |
| SMILES | CCCNC(CN(C(CCl)=O)C)=O |
| Synonyms | 2-chloro-N-methyl-N-[(propylcarbamoyl)methyl]acetamide,
850020-75-6,
2-chloro-N-methyl-N-[2-oxo-2-(propylamino)ethyl]acetamide,
AC1M9GAF,
AC1Q2Y14,
CTK6E5243,
ZINC3491318,
AKOS001122156,
NE13261,
EN300-12204,
2-[(2-chloroacetyl)-methylamino]-N-propylacetamide,
Z85929541,
ZINC03491318,
CID2608600,
Acetamide, 2-chloro-N-methyl-N-[2-oxo-2-(propylamino)ethyl],
|
| Complexity | 185 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 206.082g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 206.67g/mol |
| Monoisotopic Mass | 206.082g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 49.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.6 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number