2,6-dimethoxyquinoline-3-carbaldehyde

2,6-dimethoxyquinoline-3-carbaldehyde

CAS: 883549-54-0

Formula: C12H11NO3

SMILES: COC1=CC2=CC(C=O)=C(OC)N=C2C=C1

IUPAC: 2,6-dimethoxyquinoline-3-carbaldehyde

InChI: InChI=1S/C12H11NO3/c1-15-10-3-4-11-8(6-10)5-9(7-14)12(13-11)16-2/h3-7H,1-2H3

Composition: C (66.35%), H (5.10%), N (6.45%), O (22.10%)

Molar Mass: 217.224

Atom Count: 27

Heavy Atom Count: 16

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	217.073893218
Formal Charge	0
FSP3	0.17
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
InChIKey	QEVPUKVDQCVMGD-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	59.8
Topological Polar Surface Area	48.42
Polarizability	23.87
Ring Count	2
Rotatable Bond Count	3

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