ethyl 8-fluoro-4-hydroxy-5-methylquinoline-3-carboxylate

ethyl 8-fluoro-4-hydroxy-5-methylquinoline-3-carboxylate

CAS: 329698-70-6

Formula: C13H12FNO3

SMILES: CCOC(=O)C1=C(O)C2=C(C)C=CC(F)=C2N=C1

IUPAC: ethyl 8-fluoro-4-hydroxy-5-methylquinoline-3-carboxylate

InChI: InChI=1S/C13H12FNO3/c1-3-18-13(17)8-6-15-11-9(14)5-4-7(2)10(11)12(8)16/h4-6H,3H2,1-2H3,(H,15,16)

Composition: C (62.65%), H (4.85%), F (7.62%), N (5.62%), O (19.26%)

Molar Mass: 249.241

Atom Count: 30

Heavy Atom Count: 18

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	249.080121413
Formal Charge	0
FSP3	0.23
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	WXTJXMZDOOCUSN-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	63.99
Topological Polar Surface Area	59.42
Polarizability	25.25
Ring Count	2
Rotatable Bond Count	3

Suppliers

Key Organics Ltd

Supplier Profile

Purity	LeadTime	CAS	PacketSize	UnitPrice
90%	<2 Days	329698-70-6		$51.35-$524.40$51.35$63.37$86.31$524.40