3-(benzyloxy)-5-chloro-2-methoxypyridine

3-(benzyloxy)-5-chloro-2-methoxypyridine

CAS: 1242336-52-2

Formula: C13H12ClNO2

SMILES: COC1=NC=C(Cl)C=C1OCC1=CC=CC=C1

IUPAC: 3-(benzyloxy)-5-chloro-2-methoxypyridine

InChI: InChI=1S/C13H12ClNO2/c1-16-13-12(7-11(14)8-15-13)17-9-10-5-3-2-4-6-10/h2-8H,9H2,1H3

Composition: C (62.53%), H (4.84%), Cl (14.20%), N (5.61%), O (12.81%)

Molar Mass: 249.69

Atom Count: 29

Heavy Atom Count: 17

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	249.0556563
Formal Charge	0
FSP3	0.15
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
InChIKey	UMXFFXZBNLBAOS-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	66.56
Topological Polar Surface Area	31.35
Polarizability	25.94
Ring Count	2
Rotatable Bond Count	4

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