3-bromo-2,6-diiodo-5-methoxypyridine

3-bromo-2,6-diiodo-5-methoxypyridine

CAS: 1040682-61-8

Formula: C6H4BrI2NO

SMILES: COC1=C(I)N=C(I)C(Br)=C1

IUPAC: 3-bromo-2,6-diiodo-5-methoxypyridine

InChI: InChI=1S/C6H4BrI2NO/c1-11-4-2-3(7)5(8)10-6(4)9/h2H,1H3

Composition: C (16.39%), H (0.92%), Br (18.17%), I (57.71%), N (3.18%), O (3.64%)

Molar Mass: 439.817

Atom Count: 15

Heavy Atom Count: 11

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	438.75657
Formal Charge	0
FSP3	0.17
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	GDIKLFGDHVQDIW-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	64.13
Topological Polar Surface Area	22.12
Polarizability	26.15
Ring Count	1
Rotatable Bond Count	1

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