| CAS Number | 1208828-89-0 |
| Catalog Number | AG019KQQ |
| Chemical Name | N-(2-acetyl-1-benzofuran-3-yl)-2-chloropropanamide |
| IUPAC Name | N-(2-acetyl-1-benzofuran-3-yl)-2-chloropropanamide |
| InChI | InChI=1S/C13H12ClNO3/c1-7(14)13(17)15-11-9-5-3-4-6-10(9)18-12(11)8(2)16/h3-7H,1-2H3,(H,15,17) |
| InChI Key | RAVVZTNDELOMLA-UHFFFAOYSA-N |
| MDL Number | MFCD13195796 |
| Molecular Formula | C13H12ClNO3 |
| Molecular Weight | 265.6923 |
| SMILES | CC(C(NC1C2=C(C=CC=C2)OC=1C(C)=O)=O)Cl |
| Synonyms | N-(2-acetyl-1-benzofuran-3-yl)-2-chloropropanamide,
1208828-89-0,
2-chloro-N-(2-acetyl-1-benzofuran-3-yl)propanamide,
AC1Q2AVU,
CTK6A3066,
NE26791,
EN300-28041,
|
| Complexity | 347 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 265.051g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 265.693g/mol |
| Monoisotopic Mass | 265.051g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 59.3A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number