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Home > Imidazoles > 849900-42-1
849900-42-1 | 1H-Imidazolium, 1-methoxy-3-methyl-, iodide
CAS No: 849900-42-1 Catalog No: AG004QDD MDL No:
Product Description
Catalog Number:
AG004QDD
Chemical Name:
1H-Imidazolium, 1-methoxy-3-methyl-, iodide
CAS Number:
849900-42-1
Molecular Formula:
C5H11IN2O
Molecular Weight:
242.0581
IUPAC Name:
1-methoxy-3-methyl-1,2-dihydroimidazol-1-ium;iodide
InChI:
InChI=1S/C5H10N2O.HI/c1-6-3-4-7(5-6)8-2;/h3-4H,5H2,1-2H3;1H
InChI Key:
OYNNRQTZEPMWGT-UHFFFAOYSA-N
SMILES:
CO[NH+]1C=CN(C1)C.[I-]
Properties
Complexity:
103
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
241.992g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
242.06g/mol
Monoisotopic Mass:
241.992g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
16.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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