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51647-90-6 | Imidazo[1,2-a]pyrimidine-5,7-diol
CAS No: 51647-90-6 Catalog No: AG006UFG MDL No:MFCD09834820
Product Description
Catalog Number:
AG006UFG
Chemical Name:
Imidazo[1,2-a]pyrimidine-5,7-diol
CAS Number:
51647-90-6
Molecular Formula:
C6H5N3O2
Molecular Weight:
151.1228
MDL Number:
MFCD09834820
IUPAC Name:
5-hydroxy-8H-imidazo[1,2-a]pyrimidin-7-one
InChI:
InChI=1S/C6H5N3O2/c10-4-3-5(11)9-2-1-7-6(9)8-4/h1-3,11H,(H,7,8,10)
InChI Key:
BELWUABPSOOYPK-UHFFFAOYSA-N
SMILES:
Oc1cc(O)n2c(n1)ncc2
Properties
Complexity:
226
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
151.038g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
151.125g/mol
Monoisotopic Mass:
151.038g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
67.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.6
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