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82272-28-4 | (Cyanomethyl)trimethylammonium iodide
CAS No: 82272-28-4 Catalog No: AG005GI4 MDL No:
Product Description
Catalog Number:
AG005GI4
Chemical Name:
(Cyanomethyl)trimethylammonium iodide
CAS Number:
82272-28-4
Molecular Formula:
C5H11IN2
Molecular Weight:
226.0587
IUPAC Name:
cyanomethyl(trimethyl)azanium;iodide
InChI:
InChI=1S/C5H11N2.HI/c1-7(2,3)5-4-6;/h5H2,1-3H3;1H/q+1;/p-1
InChI Key:
DLUXOICIYRXRNK-UHFFFAOYSA-M
SMILES:
N#CC[N+](C)(C)C.[I-]
Properties
Complexity:
90.4
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
225.997g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
226.061g/mol
Monoisotopic Mass:
225.997g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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