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trimethyl(pyridin-4-ylmethyl)azanium iodide

trimethyl(pyridin-4-ylmethyl)azanium iodide

CAS: 20863-50-7

Formula: C9H15IN2

SMILES: [I-].C[N+](C)(C)CC1=CC=NC=C1

IUPAC: trimethyl[(pyridin-4-yl)methyl]azanium iodide

InChI: InChI=1S/C9H15N2.HI/c1-11(2,3)8-9-4-6-10-7-5-9;/h4-7H,8H2,1-3H3;1H/q+1;/p-1

Composition: C (38.87%), H (5.44%), I (45.63%), N (10.07%)

Molar Mass: 278.137

Atom Count: 27

Heavy Atom Count: 12

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 278.02799
Formal Charge 0
FSP3 0.44
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 0
InChIKey RBTUWEPPTFOMMX-UHFFFAOYSA-M
Lipinski's Rule of Five 1
Molar Refractivity 58.36
Topological Polar Surface Area 12.89
Polarizability 18.26
Ring Count 1
Rotatable Bond Count 2

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