2-Heptylquinolin-4(1H)-one

Catalog Number	ACM40522461-1
CAS	40522-46-1
Structure
IUPAC Name	2-heptyl-1H-quinolin-4-one
Synonyms	2-heptylquinolin-4(1H)-one;40522-46-1;2-heptyl-4-quinolone;2-heptyl-4(1H)-quinolone;2-heptyl-1H-quinolin-4-one;2503-80-2;TCMDC-132026;2-Heptyl-4-hydroxyquinoline;MY-12-62c;2-heptylquinolin-4-ol;MY 12-62c;HHQ;4-hydroxy-2-heptylquinoline;CHEBI:62219;2-heptyl-1~{H}-quinolin-4-one;Pyo Ib;4-Quinolinol, 2-heptyl-;pseudan VII;SCHEMBL170164;2-n-heptyl-4-hydroxyquinoline;CHEMBL527817;MY12-62c;CHEBI:75306;DTXSID00179740;MFCD16619170;ZINC48307275;2-heptyl-1,4-dihydroquinolin-4-one;AKOS015899644;HHQ aka 2-heptylquinolin-4(1H)-one;MP-2019;AK118992;AS-59174;DA-26185;FT-0764828;Z4710;C20643;522H461;HLH
Molecular Weight	243.34g/mol
Molecular Formula	C16H21NO
Canonical SMILES	CCCCCCCC1=CC(=O)C2=CC=CC=C2N1
InChI	InChI=1S/C16H21NO/c1-2-3-4-5-6-9-13-12-16(18)14-10-7-8-11-15(14)17-13/h7-8,10-12H,2-6,9H2,1H3,(H,17,18)
InChI Key	UYRHHBXYXSYGHA-UHFFFAOYSA-N
Complexity	308
Covalently-Bonded Unit Count	1
Exact Mass	243.162314293g/mol
Heavy Atom Count	18
Hydrogen Bond Acceptor Count	2
Monoisotopic Mass	243.162314293g/mol
Rotatable Bond Count	6
Topological Polar Surface Area	29.1Å²
X Log P3	4.9

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