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67513-76-2 | 9H-Imidazo[1,2-a]purin-9-one, 3,4-dihydro-3,4,6-trimethyl-
CAS No: 67513-76-2 Catalog No: AG0060CB MDL No:
Product Description
Catalog Number:
AG0060CB
Chemical Name:
9H-Imidazo[1,2-a]purin-9-one, 3,4-dihydro-3,4,6-trimethyl-
CAS Number:
67513-76-2
Molecular Formula:
C10H11N5O
Molecular Weight:
217.2272
IUPAC Name:
3,4,6-trimethylimidazo[1,2-a]purin-9-one
InChI:
InChI=1S/C10H11N5O/c1-6-4-15-9(16)7-8(13(2)5-11-7)14(3)10(15)12-6/h4-5H,1-3H3
InChI Key:
NBLOJSAIYDDVJT-UHFFFAOYSA-N
SMILES:
Cc1cn2c(n1)n(C)c1c(c2=O)ncn1C
Properties
Complexity:
322
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
217.096g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
217.232g/mol
Monoisotopic Mass:
217.096g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
56A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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