propyl 3-propoxypyridine-2-carboxylate

propyl 3-propoxypyridine-2-carboxylate

CAS: 134319-22-5

Formula: C12H17NO3

SMILES: CCCOC(=O)C1=NC=CC=C1OCCC

IUPAC: propyl 3-propoxypyridine-2-carboxylate

InChI: InChI=1S/C12H17NO3/c1-3-8-15-10-6-5-7-13-11(10)12(14)16-9-4-2/h5-7H,3-4,8-9H2,1-2H3

Composition: C (64.55%), H (7.67%), N (6.27%), O (21.50%)

Molar Mass: 223.272

Atom Count: 33

Heavy Atom Count: 16

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	223.120843411
Formal Charge	0
FSP3	0.5
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
InChIKey	ZGUCGLNLZXLQTD-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	60.56
Topological Polar Surface Area	48.42
Polarizability	23.75
Ring Count	1
Rotatable Bond Count	7

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