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19760-15-7 | Pyridinium, 1-ethyl-2-methyl-, iodide (1:1)
CAS No: 19760-15-7 Catalog No: AG002AXA MDL No:
Product Description
Catalog Number:
AG002AXA
Chemical Name:
Pyridinium, 1-ethyl-2-methyl-, iodide (1:1)
CAS Number:
19760-15-7
Molecular Formula:
C8H12IN
Molecular Weight:
249.0921
IUPAC Name:
1-ethyl-2-methylpyridin-1-ium;iodide
InChI:
InChI=1S/C8H12N.HI/c1-3-9-7-5-4-6-8(9)2;/h4-7H,3H2,1-2H3;1H/q+1;/p-1
InChI Key:
NMYWANRCPFUKKO-UHFFFAOYSA-M
SMILES:
CC[n+]1ccccc1C.[I-]
Properties
Complexity:
80.6
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
249.001g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
249.095g/mol
Monoisotopic Mass:
249.001g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
3.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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