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29280-77-1 | Piperidinium, 1,1,2,5-tetramethyl-4-oxo-, iodide (1:1)
CAS No: 29280-77-1 Catalog No: AG002XY6 MDL No:
Product Description
Catalog Number:
AG002XY6
Chemical Name:
Piperidinium, 1,1,2,5-tetramethyl-4-oxo-, iodide (1:1)
CAS Number:
29280-77-1
Molecular Formula:
C9H18INO
Molecular Weight:
283.1498
IUPAC Name:
1,1,2,5-tetramethylpiperidin-1-ium-4-one;iodide
InChI:
InChI=1S/C9H18NO.HI/c1-7-6-10(3,4)8(2)5-9(7)11;/h7-8H,5-6H2,1-4H3;1H/q+1;/p-1
InChI Key:
PFDONELVNCDSHB-UHFFFAOYSA-M
SMILES:
CC1C[N+](C)(C)C(CC1=O)C.[I-]
Properties
Complexity:
174
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
283.043g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
283.153g/mol
Monoisotopic Mass:
283.043g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
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