4-(4,8-dichloro-2-methylquinolin-3-yl)butan-2-one

4-(4,8-dichloro-2-methylquinolin-3-yl)butan-2-one

CAS: 64375-69-5

Formula: C14H13Cl2NO

SMILES: CC(=O)CCC1=C(Cl)C2=CC=CC(Cl)=C2N=C1C

IUPAC: 4-(4,8-dichloro-2-methylquinolin-3-yl)butan-2-one

InChI: InChI=1S/C14H13Cl2NO/c1-8(18)6-7-10-9(2)17-14-11(13(10)16)4-3-5-12(14)15/h3-5H,6-7H2,1-2H3

Composition: C (59.59%), H (4.64%), Cl (25.13%), N (4.96%), O (5.67%)

Molar Mass: 282.16

Atom Count: 31

Heavy Atom Count: 18

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	281.0374194
Formal Charge	0
FSP3	0.29
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	MOKWWJGOBBVWHO-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	73.64
Topological Polar Surface Area	29.96
Polarizability	29.9
Ring Count	2
Rotatable Bond Count	3

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