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921604-77-5 | 1H-Imidazole, 3-oxide
CAS No: 921604-77-5 Catalog No: AG006HX8 MDL No:
Product Description
Catalog Number:
AG006HX8
Chemical Name:
1H-Imidazole, 3-oxide
CAS Number:
921604-77-5
Molecular Formula:
C3H4N2O
Molecular Weight:
84.0767
IUPAC Name:
1-hydroxyimidazole
InChI:
InChI=1S/C3H4N2O/c6-5-2-1-4-3-5/h1-3,6H
InChI Key:
OPFNZHIUHJBGEW-UHFFFAOYSA-N
SMILES:
[O-][n+]1c[nH]cc1
Properties
Complexity:
48.1
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
84.032g/mol
Formal Charge:
0
Heavy Atom Count:
6
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
84.078g/mol
Monoisotopic Mass:
84.032g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
38A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0
Literature
| Title | Journal |
|---|---|
| Microwave-assisted synthesis of 2,4,5-triaryl-imidazole; a novel thermally induced N-hydroxyimidazole N-O bond cleavage. | Organic letters 20040708 |
| Novel 1-hydroxyazole bioisosteres of glutamic acid. Synthesis, protolytic properties, and pharmacology. | Journal of medicinal chemistry 20020103 |
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