CAS 123990-78-3 | 3-Quinolinecarboxaldehyde, 1,2-dihydro-6-methoxy-2-oxo- | CAS Number 123990-78-3

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123990-78-3 | 3-Quinolinecarboxaldehyde, 1,2-dihydro-6-methoxy-2-oxo-

CAS No: 123990-78-3 Catalog No: AG000LC5 MDL No:MFCD02227056

Product Description

Catalog Number:

AG000LC5

Chemical Name:

3-Quinolinecarboxaldehyde, 1,2-dihydro-6-methoxy-2-oxo-

CAS Number:

123990-78-3

Molecular Formula:

C11H9NO3

Molecular Weight:

203.1941

MDL Number:

MFCD02227056

IUPAC Name:

6-methoxy-2-oxo-1H-quinoline-3-carbaldehyde

InChI:

InChI=1S/C11H9NO3/c1-15-9-2-3-10-7(5-9)4-8(6-13)11(14)12-10/h2-6H,1H3,(H,12,14)

InChI Key:

CUYFVLXHUGFIPJ-UHFFFAOYSA-N

SMILES:

COc1ccc2c(c1)cc(c(=O)[nH]2)C=O

Properties

Complexity:

311

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

203.058g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

203.197g/mol

Monoisotopic Mass:

203.058g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

55.4A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

Literature

Title	Journal
Mixed ligand palladium(II) complexes of 6-methoxy-2-oxo-1,2-dihydroquinoline-3-carbaldehyde 4N-substituted thiosemicarbazones with triphenylphosphine co-ligand: synthesis, crystal structure and biological properties.	Dalton transactions (Cambridge, England : 2003) 20121121