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166746-03-8 | Piperidinium, 1,1-diethyl-3,5-dimethyl-, iodide (1:1)
CAS No: 166746-03-8 Catalog No: AG001WX4 MDL No:
Product Description
Catalog Number:
AG001WX4
Chemical Name:
Piperidinium, 1,1-diethyl-3,5-dimethyl-, iodide (1:1)
CAS Number:
166746-03-8
Molecular Formula:
C11H24IN
Molecular Weight:
297.2194
IUPAC Name:
1,1-diethyl-3,5-dimethylpiperidin-1-ium;iodide
InChI:
InChI=1S/C11H24N.HI/c1-5-12(6-2)8-10(3)7-11(4)9-12;/h10-11H,5-9H2,1-4H3;1H/q+1;/p-1
InChI Key:
OCFHEURMNFXOSE-UHFFFAOYSA-M
SMILES:
CC[N+]1(CC)CC(C)CC(C1)C.[I-]
Properties
Complexity:
126
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
297.095g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
297.224g/mol
Monoisotopic Mass:
297.095g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
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