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Home > Imidazoles > 918158-35-7
918158-35-7 | 1H-Indene-1,3(2H)-dione, 2-(5,6-dimethyl-1H-benzimidazol-2-yl)-
CAS No: 918158-35-7 Catalog No: AG006LAE MDL No:
Product Description
Catalog Number:
AG006LAE
Chemical Name:
1H-Indene-1,3(2H)-dione, 2-(5,6-dimethyl-1H-benzimidazol-2-yl)-
CAS Number:
918158-35-7
Molecular Formula:
C18H14N2O2
Molecular Weight:
290.3160
IUPAC Name:
2-(5,6-dimethyl-1H-benzimidazol-2-yl)indene-1,3-dione
InChI:
InChI=1S/C18H14N2O2/c1-9-7-13-14(8-10(9)2)20-18(19-13)15-16(21)11-5-3-4-6-12(11)17(15)22/h3-8,15H,1-2H3,(H,19,20)
InChI Key:
LZWVSUWZKCSARZ-UHFFFAOYSA-N
SMILES:
O=C1C(c2[nH]c3c(n2)cc(c(c3)C)C)C(=O)c2c1cccc2
Properties
Complexity:
468
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
290.106g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
290.322g/mol
Monoisotopic Mass:
290.106g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
62.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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