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55662-34-5 | 5-methylimidazo[1,2-a]pyrimidin-7(8H)-one
CAS No: 55662-34-5 Catalog No: AG01C7E0 MDL No:MFCD24572628
Product Description
Catalog Number:
AG01C7E0
Chemical Name:
5-methylimidazo[1,2-a]pyrimidin-7(8H)-one
CAS Number:
55662-34-5
Molecular Formula:
C7H7N3O
Molecular Weight:
149.1500
MDL Number:
MFCD24572628
IUPAC Name:
5-methyl-8H-imidazo[1,2-a]pyrimidin-7-one
InChI:
InChI=1S/C7H7N3O/c1-5-4-6(11)9-7-8-2-3-10(5)7/h2-4H,1H3,(H,8,9,11)
InChI Key:
GVWALDUEYDNXOO-UHFFFAOYSA-N
SMILES:
O=c1cc(C)n2c([nH]1)ncc2
Properties
Complexity:
224
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
149.059g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
149.153g/mol
Monoisotopic Mass:
149.059g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
46.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1
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