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methyl 2-(4-hydroxy-3-methoxyphenyl)quinoline-4-carboxylate

methyl 2-(4-hydroxy-3-methoxyphenyl)quinoline-4-carboxylate

CAS: 133676-10-5

Formula: C18H15NO4

SMILES: COC(=O)C1=C2C=CC=CC2=NC(=C1)C1=CC(OC)=C(O)C=C1

IUPAC: methyl 2-(4-hydroxy-3-methoxyphenyl)quinoline-4-carboxylate

InChI: InChI=1S/C18H15NO4/c1-22-17-9-11(7-8-16(17)20)15-10-13(18(21)23-2)12-5-3-4-6-14(12)19-15/h3-10,20H,1-2H3

Composition: C (69.89%), H (4.89%), N (4.53%), O (20.69%)

Molar Mass: 309.321

Atom Count: 38

Heavy Atom Count: 23

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 309.100107967
Formal Charge 0
FSP3 0.11
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 1
InChIKey QCBSPDBBULDMAN-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 85.21
Topological Polar Surface Area 68.65
Polarizability 35.46
Ring Count 3
Rotatable Bond Count 4

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