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70710-06-4 | Pyridinium, 2-methyl-1-octadecyl-, iodide
CAS No: 70710-06-4 Catalog No: AG005SS9 MDL No:
Product Description
Catalog Number:
AG005SS9
Chemical Name:
Pyridinium, 2-methyl-1-octadecyl-, iodide
CAS Number:
70710-06-4
Molecular Formula:
C24H44IN
Molecular Weight:
473.5173
IUPAC Name:
2-methyl-1-octadecylpyridin-1-ium;iodide
InChI:
InChI=1S/C24H44N.HI/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-19-22-25-23-20-18-21-24(25)2;/h18,20-21,23H,3-17,19,22H2,1-2H3;1H/q+1;/p-1
InChI Key:
ANAVKDKVQLBHCP-UHFFFAOYSA-M
SMILES:
CCCCCCCCCCCCCCCCCC[n+]1ccccc1C.[I-]
Properties
Complexity:
263
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
473.252g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
473.527g/mol
Monoisotopic Mass:
473.252g/mol
Rotatable Bond Count:
17
Topological Polar Surface Area:
3.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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