| CAS Number | 1042640-27-6 |
| Catalog Number | AG0099XR(AGN-PC-0WQVNK) |
| Chemical Name | N-(2-Acetylphenyl)-4-methylpentanamide |
| IUPAC Name | N-(2-acetylphenyl)-4-methylpentanamide |
| InChI | InChI=1S/C14H19NO2/c1-10(2)8-9-14(17)15-13-7-5-4-6-12(13)11(3)16/h4-7,10H,8-9H2,1-3H3,(H,15,17) |
| InChI Key | CYBDNUNLWQQOBK-UHFFFAOYSA-N |
| MDL Number | MFCD11170459 |
| Molecular Formula | C14H19NO2 |
| Molecular Weight | 233.3062 |
| SMILES | CC(C)CCC(=O)Nc1ccccc1C(C)=O |
| Synonyms | N-(2-acetylphenyl)-4-methylpentanamide,
1042640-27-6,
MFCD11170459,
ZINC20252519,
AKOS008918077,
CS-0038587,
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| Complexity | 273 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 233.142g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 233.311g/mol |
| Monoisotopic Mass | 233.142g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 46.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.1 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number