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3-bromo-1-methylpyridin-1-ium iodide

3-bromo-1-methylpyridin-1-ium iodide

CAS: 32222-42-7

Formula: C6H7BrIN

SMILES: [I-].C[N+]1=CC(Br)=CC=C1

IUPAC: 3-bromo-1-methylpyridin-1-ium iodide

InChI: InChI=1S/C6H7BrN.HI/c1-8-4-2-3-6(7)5-8;/h2-5H,1H3;1H/q+1;/p-1

Composition: C (24.03%), H (2.35%), Br (26.64%), I (42.31%), N (4.67%)

Molar Mass: 299.937

Atom Count: 16

Heavy Atom Count: 9

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 298.88066
Formal Charge 0
FSP3 0.17
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 0
Hydrogen Bond Donor Count 0
InChIKey CTRITASIILKTKI-UHFFFAOYSA-M
Lipinski's Rule of Five 1
Molar Refractivity 37.68
Topological Polar Surface Area 3.88
Polarizability 14.27
Ring Count 1
Rotatable Bond Count 0

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