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114141-97-8 | 2H-Pyrano[2,3-d]pyrimidin-2-one, 1,7-dihydro-4,5,7,7-tetramethyl-
CAS No: 114141-97-8 Catalog No: AG000ANU MDL No:
Product Description
Catalog Number:
AG000ANU
Chemical Name:
2H-Pyrano[2,3-d]pyrimidin-2-one, 1,7-dihydro-4,5,7,7-tetramethyl-
CAS Number:
114141-97-8
Molecular Formula:
C11H14N2O2
Molecular Weight:
206.2411
IUPAC Name:
4,5,7,7-tetramethyl-3H-pyrano[2,3-d]pyrimidin-2-one
InChI:
InChI=1S/C11H14N2O2/c1-6-5-11(3,4)15-9-8(6)7(2)12-10(14)13-9/h5H,1-4H3,(H,12,13,14)
InChI Key:
FIPGZGPEPXGZJU-UHFFFAOYSA-N
SMILES:
CC1=CC(C)(C)Oc2c1c(C)nc(=O)[nH]2
Properties
Complexity:
428
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.106g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
206.245g/mol
Monoisotopic Mass:
206.106g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
50.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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