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114887-22-8 | Pyridinium, 1-(2-iodoethyl)-, iodide (1:1)
CAS No: 114887-22-8 Catalog No: AG000FEJ MDL No:
Product Description
Catalog Number:
AG000FEJ
Chemical Name:
Pyridinium, 1-(2-iodoethyl)-, iodide (1:1)
CAS Number:
114887-22-8
Molecular Formula:
C7H9I2N
Molecular Weight:
360.9620
IUPAC Name:
1-(2-iodoethyl)pyridin-1-ium;iodide
InChI:
InChI=1S/C7H9IN.HI/c8-4-7-9-5-2-1-3-6-9;/h1-3,5-6H,4,7H2;1H/q+1;/p-1
InChI Key:
ICEDWTMMAQLCTQ-UHFFFAOYSA-M
SMILES:
ICC[n+]1ccccc1.[I-]
Properties
Complexity:
69.3
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
360.882g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
360.965g/mol
Monoisotopic Mass:
360.882g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
3.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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