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2-Heptyl-3-hydroxyquinolin-4(1H)-one
| Catalog Number | ACM108985279-1 |
| CAS | 108985-27-9 |
| Structure |  |
| IUPAC Name | 2-heptyl-3-hydroxy-3H-quinolin-4-one |
| Synonyms | 108985-27-9;2-heptyl-3-hydroxyquinolin-4(1H)-one;2-heptyl-3-hydroxy-3H-quinolin-4-one;ACMC-20mby7;4(1H)-Quinolinone,2-heptyl-3-hydroxy-;AC1L9ENZ;SureCN130920;SCHEMBL130920;DTXSID10332086;AKOS016009667;AK-32824;AS-62616;DB-059803;2-heptyl-3-hydroxy-3,4-dihydroquinolin-4-one |
| Molecular Weight | 259.34g/mol |
| Molecular Formula | C16H21NO2 |
| Canonical SMILES | CCCCCCCC1=NC2=CC=CC=C2C(=O)C1O |
| InChI | InChI=1S/C16H21NO2/c1-2-3-4-5-6-11-14-16(19)15(18)12-9-7-8-10-13(12)17-14/h7-10,16,19H,2-6,11H2,1H3 |
| InChI Key | IRNQEHWHRAZAPL-UHFFFAOYSA-N |
| Complexity | 338 |
| Covalently-Bonded Unit Count | 1 |
| Exact Mass | 259.157228913g/mol |
| Heavy Atom Count | 19 |
| Hydrogen Bond Acceptor Count | 3 |
| Monoisotopic Mass | 259.157228913g/mol |
| Rotatable Bond Count | 6 |
| Topological Polar Surface Area | 49.7Ų |
| X Log P3 | 3.8 |
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