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132286-19-2 | 9H-Indeno[1,2-b]pyrazine-2,3-dicarbonitrile, 7-methoxy-9-oxo-
CAS No: 132286-19-2 Catalog No: AG0010H4 MDL No:
Product Description
Catalog Number:
AG0010H4
Chemical Name:
9H-Indeno[1,2-b]pyrazine-2,3-dicarbonitrile, 7-methoxy-9-oxo-
CAS Number:
132286-19-2
Molecular Formula:
C14H6N4O2
Molecular Weight:
262.2230
IUPAC Name:
7-methoxy-9-oxoindeno[1,2-b]pyrazine-2,3-dicarbonitrile
InChI:
InChI=1S/C14H6N4O2/c1-20-7-2-3-8-9(4-7)14(19)13-12(8)17-10(5-15)11(6-16)18-13/h2-4H,1H3
InChI Key:
VNEKQHNZUGFLEO-UHFFFAOYSA-N
SMILES:
COc1ccc2c(c1)C(=O)c1c2nc(c(n1)C#N)C#N
Properties
Complexity:
516
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
262.049g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
262.228g/mol
Monoisotopic Mass:
262.049g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
99.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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