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Home > Imidazoles > 116451-44-6
116451-44-6 | 2H-Imidazol-2-one, 1,3-dihydro-1-hydroxy-
CAS No: 116451-44-6 Catalog No: AG000CJH MDL No:
Product Description
Catalog Number:
AG000CJH
Chemical Name:
2H-Imidazol-2-one, 1,3-dihydro-1-hydroxy-
CAS Number:
116451-44-6
Molecular Formula:
C3H4N2O2
Molecular Weight:
100.0761
IUPAC Name:
3-hydroxy-1H-imidazol-2-one
InChI:
InChI=1S/C3H4N2O2/c6-3-4-1-2-5(3)7/h1-2,7H,(H,4,6)
InChI Key:
KUERBWLVQJAKIS-UHFFFAOYSA-N
SMILES:
On1cc[nH]c1=O
Properties
Complexity:
120
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
100.027g/mol
Formal Charge:
0
Heavy Atom Count:
7
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
100.077g/mol
Monoisotopic Mass:
100.027g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.2
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