| CAS Number | 87603-53-0 |
| Catalog Number | AG019KPD |
| Chemical Name | N-(butan-2-yl)-2-chloropropanamide |
| IUPAC Name | N-butan-2-yl-2-chloropropanamide |
| InChI | InChI=1S/C7H14ClNO/c1-4-5(2)9-7(10)6(3)8/h5-6H,4H2,1-3H3,(H,9,10) |
| InChI Key | RECKOKCQSMADRC-UHFFFAOYSA-N |
| MDL Number | MFCD09950865 |
| Molecular Formula | C7H14ClNO |
| Molecular Weight | 163.6452 |
| SMILES | CCC(NC(C(Cl)C)=O)C |
| Synonyms | N-(butan-2-yl)-2-chloropropanamide,
87603-53-0,
AC1Q2SA8,
SCHEMBL11071385,
CTK6C9152,
AKOS000196691,
AKOS022340930,
NE21157,
EN300-27878,
|
| Complexity | 116 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 163.076g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 163.645g/mol |
| Monoisotopic Mass | 163.076g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 29.1A^2 |
| Undefined Atom Stereocenter Count | 2 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number