ethyl 4-acetylpyridine-2-carboxylate

ethyl 4-acetylpyridine-2-carboxylate

CAS: 135450-67-8

Formula: C10H11NO3

SMILES: CCOC(=O)C1=CC(=CC=N1)C(C)=O

IUPAC: ethyl 4-acetylpyridine-2-carboxylate

InChI: InChI=1S/C10H11NO3/c1-3-14-10(13)9-6-8(7(2)12)4-5-11-9/h4-6H,3H2,1-2H3

Composition: C (62.17%), H (5.74%), N (7.25%), O (24.84%)

Molar Mass: 193.202

Atom Count: 25

Heavy Atom Count: 14

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	193.073893218
Formal Charge	0
FSP3	0.3
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
InChIKey	LHZOLNKTOSTVQK-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	50.71
Topological Polar Surface Area	56.26
Polarizability	19.46
Ring Count	1
Rotatable Bond Count	4

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