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Home > Imidazoles > 73590-97-3
73590-97-3 | Ethanone, 1-(2,3-dihydro-6-methyl-2-thioxo-1H-benzimidazol-5-yl)-
CAS No: 73590-97-3 Catalog No: AG005CO4 MDL No:
Product Description
Catalog Number:
AG005CO4
Chemical Name:
Ethanone, 1-(2,3-dihydro-6-methyl-2-thioxo-1H-benzimidazol-5-yl)-
CAS Number:
73590-97-3
Molecular Formula:
C10H10N2OS
Molecular Weight:
206.2642
IUPAC Name:
1-(6-methyl-2-sulfanylidene-1,3-dihydrobenzimidazol-5-yl)ethanone
InChI:
InChI=1S/C10H10N2OS/c1-5-3-8-9(12-10(14)11-8)4-7(5)6(2)13/h3-4H,1-2H3,(H2,11,12,14)
InChI Key:
KQLAYLRTDPEJBE-UHFFFAOYSA-N
SMILES:
CC(=O)c1cc2[nH]c(=S)[nH]c2cc1C
Properties
Complexity:
279
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.051g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
206.263g/mol
Monoisotopic Mass:
206.051g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
73.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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