| CAS Number | 1016841-03-4 |
| Catalog Number | AG0099XP(AGN-PC-0WQVNF) |
| Chemical Name | N-(2-acetylphenyl)pentanamide |
| IUPAC Name | N-(2-acetylphenyl)pentanamide |
| InChI | InChI=1S/C13H17NO2/c1-3-4-9-13(16)14-12-8-6-5-7-11(12)10(2)15/h5-8H,3-4,9H2,1-2H3,(H,14,16) |
| InChI Key | QTIIZXKGHCTSLY-UHFFFAOYSA-N |
| MDL Number | MFCD09948984 |
| Molecular Formula | C13H17NO2 |
| Molecular Weight | 219.2796 |
| SMILES | CCCCC(=O)Nc1ccccc1C(C)=O |
| Synonyms | N-(2-acetylphenyl)pentanamide,
1016841-03-4,
MFCD09948984,
ZINC19515826,
AKOS000191938,
CS-0038583,
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| Complexity | 250 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 219.126g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 219.284g/mol |
| Monoisotopic Mass | 219.126g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 46.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.9 |
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Certificate of Analysis
Lot Number