CAS 73568-29-3 | 2-Chloro-6-methoxyquinoline-3-carbaldehyde | CAS Number 73568-29-3

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73568-29-3 | 2-Chloro-6-methoxyquinoline-3-carbaldehyde

CAS No: 73568-29-3 Catalog No: AG003H0O MDL No:MFCD00160585

Product Description

Catalog Number:

AG003H0O

Chemical Name:

2-Chloro-6-methoxyquinoline-3-carbaldehyde

CAS Number:

73568-29-3

Molecular Formula:

C11H8ClNO2

Molecular Weight:

221.6397

MDL Number:

MFCD00160585

IUPAC Name:

2-chloro-6-methoxyquinoline-3-carbaldehyde

InChI:

InChI=1S/C11H8ClNO2/c1-15-9-2-3-10-7(5-9)4-8(6-14)11(12)13-10/h2-6H,1H3

InChI Key:

TZQOMBXDCIPJKW-UHFFFAOYSA-N

SMILES:

COc1ccc2c(c1)cc(c(n2)Cl)C=O

Properties

Complexity:

237

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

221.024g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

221.64g/mol

Monoisotopic Mass:

221.024g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

39.2A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.6

Literature

Title	Journal
2-Chloro-3-[(E)-(hydrazin-1-yl-idene)meth-yl]-6-meth-oxy-quinoline.	Acta crystallographica. Section E, Structure reports online 20120501
2-Chloro-6-methoxy-quinoline-3-carbaldehyde.	Acta crystallographica. Section E, Structure reports online 20091101