| CAS Number | 265989-30-8 |
| Catalog Number | AG002TTQ(AGN-PC-0N8F6M) |
| Chemical Name | Pentanamide, 4-methyl-3-oxo-N-[4-(phenylmethoxy)phenyl]- |
| IUPAC Name | 4-methyl-3-oxo-N-(4-phenylmethoxyphenyl)pentanamide |
| InChI | InChI=1S/C19H21NO3/c1-14(2)18(21)12-19(22)20-16-8-10-17(11-9-16)23-13-15-6-4-3-5-7-15/h3-11,14H,12-13H2,1-2H3,(H,20,22) |
| InChI Key | OUZOXSZZTRPICC-UHFFFAOYSA-N |
| MDL Number | MFCD07367713 |
| Molecular Formula | C19H21NO3 |
| Molecular Weight | 311.3749 |
| SMILES | CC(C)C(=O)CC(=O)Nc1ccc(OCc2ccccc2)cc1 |
| Synonyms | N-4-Benzyloxyphenyl Isobutyrylacetamide,
265989-30-8,
CTK8E9855,
DTXSID00443231,
ZINC22051334,
AKOS027447664,
RT-014210,
FT-0662995,
4-Methyl-3-oxo-N-[4-(phenylmethoxy)phenyl]pentanamide,
4-Methyl-3-oxopentanoic Acid N-(4-Benzyloxyphenyl)amide,
Pentanamide, 4-methyl-3-oxo-N-[4-(phenylmethoxy)phenyl]-,
CID10662825,
4-methyl-3-oxo-N-(4-phenylmethoxyphenyl)pentanamide,
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| Complexity | 380 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 311.152g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 23 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 311.381g/mol |
| Monoisotopic Mass | 311.152g/mol |
| Rotatable Bond Count | 7 |
| Topological Polar Surface Area | 55.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 4 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number