ethyl 4-chloro-8-methoxyquinoline-3-carboxylate

ethyl 4-chloro-8-methoxyquinoline-3-carboxylate

CAS: 27568-05-4

Formula: C13H12ClNO3

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

IUPAC: ethyl 4-chloro-8-methoxyquinoline-3-carboxylate

InChI: InChI=1S/C13H12ClNO3/c1-3-18-13(16)9-7-15-12-8(11(9)14)5-4-6-10(12)17-2/h4-7H,3H2,1-2H3

Composition: C (58.77%), H (4.55%), Cl (13.34%), N (5.27%), O (18.06%)

Molar Mass: 265.69

Atom Count: 30

Heavy Atom Count: 18

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	265.050571
Formal Charge	0
FSP3	0.23
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
InChIKey	BBOZDELEERNECG-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	68.02
Topological Polar Surface Area	48.42
Polarizability	27.63
Ring Count	2
Rotatable Bond Count	4

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