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Home > Indoles and Oxindole > 103518-53-2
103518-53-2 | Pyrimido[2,1-a]isoindol-2(6H)-one, 4-methyl-
CAS No: 103518-53-2 Catalog No: AG007GH1 MDL No:
Product Description
Catalog Number:
AG007GH1
Chemical Name:
Pyrimido[2,1-a]isoindol-2(6H)-one, 4-methyl-
CAS Number:
103518-53-2
Molecular Formula:
C12H10N2O
Molecular Weight:
198.2206
IUPAC Name:
4-methyl-6H-pyrimido[2,1-a]isoindol-2-one
InChI:
InChI=1S/C12H10N2O/c1-8-6-11(15)13-12-10-5-3-2-4-9(10)7-14(8)12/h2-6H,7H2,1H3
InChI Key:
FPOGOSXDTNBXOU-UHFFFAOYSA-N
SMILES:
O=c1cc(C)n2c(n1)c1ccccc1C2
Properties
Complexity:
370
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
198.079g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
198.225g/mol
Monoisotopic Mass:
198.079g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
32.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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