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97481-71-5 | 1H-Imidazole, 2,5-dihydro-1,2,2,5,5-pentamethyl-, 3-oxide
CAS No: 97481-71-5 Catalog No: AG005ZCI MDL No:
Product Description
Catalog Number:
AG005ZCI
Chemical Name:
1H-Imidazole, 2,5-dihydro-1,2,2,5,5-pentamethyl-, 3-oxide
CAS Number:
97481-71-5
Molecular Formula:
C8H16N2O
Molecular Weight:
156.2254
IUPAC Name:
2,2,3,4,4-pentamethyl-1-oxidoimidazol-1-ium
InChI:
InChI=1S/C8H16N2O/c1-7(2)6-10(11)8(3,4)9(7)5/h6H,1-5H3
InChI Key:
UNPSXBKCCZEIRN-UHFFFAOYSA-N
SMILES:
[O-][N+]1=CC(N(C1(C)C)C)(C)C
Properties
Complexity:
206
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
156.126g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
156.229g/mol
Monoisotopic Mass:
156.126g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
32A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2
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