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ethyl 2-methylquinoline-6-carboxylate

ethyl 2-methylquinoline-6-carboxylate

CAS: 855763-77-8

Formula: C13H13NO2

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

IUPAC: ethyl 2-methylquinoline-6-carboxylate

InChI: InChI=1S/C13H13NO2/c1-3-16-13(15)11-6-7-12-10(8-11)5-4-9(2)14-12/h4-8H,3H2,1-2H3

Composition: C (72.54%), H (6.09%), N (6.51%), O (14.87%)

Molar Mass: 215.252

Atom Count: 29

Heavy Atom Count: 16

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 215.094628663
Formal Charge 0
FSP3 0.23
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 0
InChIKey WLKKUWXLOSMSMH-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 61.34
Topological Polar Surface Area 39.19
Polarizability 24.98
Ring Count 2
Rotatable Bond Count 3

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