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90889-60-4 | Oxazolo[5,4-d]pyrimidin-2(1H)-one
CAS No: 90889-60-4 Catalog No: AG006GRZ MDL No:
Product Description
Catalog Number:
AG006GRZ
Chemical Name:
Oxazolo[5,4-d]pyrimidin-2(1H)-one
CAS Number:
90889-60-4
Molecular Formula:
C5H3N3O2
Molecular Weight:
137.0962
IUPAC Name:
1H-[1,3]oxazolo[5,4-d]pyrimidin-2-one
InChI:
InChI=1S/C5H3N3O2/c9-5-8-3-1-6-2-7-4(3)10-5/h1-2H,(H,8,9)
InChI Key:
YHWYVGVUFSQPKS-UHFFFAOYSA-N
SMILES:
O=c1oc2c([nH]1)cncn2
Properties
Complexity:
161
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
137.023g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
137.098g/mol
Monoisotopic Mass:
137.023g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
64.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2
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