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tetraheptylazanium iodide

tetraheptylazanium iodide

CAS: 3535-83-9

Formula: C28H60IN

SMILES: [I-].CCCCCCC[N+](CCCCCCC)(CCCCCCC)CCCCCCC

IUPAC: tetraheptylazanium iodide

InChI: InChI=1S/C28H60N.HI/c1-5-9-13-17-21-25-29(26-22-18-14-10-6-2,27-23-19-15-11-7-3)28-24-20-16-12-8-4;/h5-28H2,1-4H3;1H/q+1;/p-1

Composition: C (62.55%), H (11.25%), I (23.60%), N (2.60%)

Molar Mass: 537.699

Atom Count: 90

Heavy Atom Count: 30

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 0
Exact Mass 537.37705
Formal Charge 0
FSP3 1
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 0
Hydrogen Bond Donor Count 0
InChIKey KCSOHLKZTZMKQA-UHFFFAOYSA-M
Lipinski's Rule of Five
Molar Refractivity 146.61
Topological Polar Surface Area 0
Polarizability 53.9
Ring Count 0
Rotatable Bond Count 24

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