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trimethyl(octadecyl)azanium iodide

trimethyl(octadecyl)azanium iodide

CAS: 4292-25-5

Formula: C21H46IN

SMILES: [I-].CCCCCCCCCCCCCCCCCC[N+](C)(C)C

IUPAC: trimethyl(octadecyl)azanium iodide

InChI: InChI=1S/C21H46N.HI/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22(2,3)4;/h5-21H2,1-4H3;1H/q+1;/p-1

Composition: C (57.39%), H (10.55%), I (28.87%), N (3.19%)

Molar Mass: 439.51

Atom Count: 69

Heavy Atom Count: 23

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 0
Exact Mass 439.2675
Formal Charge 0
FSP3 1
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 0
Hydrogen Bond Donor Count 0
InChIKey HIACZXUUKNSHAN-UHFFFAOYSA-M
Lipinski's Rule of Five 1
Molar Refractivity 114.19
Topological Polar Surface Area 0
Polarizability 40.97
Ring Count 0
Rotatable Bond Count 17

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