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Home > Imidazoles > 881672-80-6
881672-80-6 | 1-(5,6-Dimethyl-1H-benzimidazol-2-yl)ethanone
CAS No: 881672-80-6 Catalog No: AG008C0T MDL No:MFCD02727128
Product Description
Catalog Number:
AG008C0T
Chemical Name:
1-(5,6-Dimethyl-1H-benzimidazol-2-yl)ethanone
CAS Number:
881672-80-6
Molecular Formula:
C11H12N2O
Molecular Weight:
188.2258
MDL Number:
MFCD02727128
IUPAC Name:
1-(5,6-dimethyl-1H-benzimidazol-2-yl)ethanone
InChI:
InChI=1S/C11H12N2O/c1-6-4-9-10(5-7(6)2)13-11(12-9)8(3)14/h4-5H,1-3H3,(H,12,13)
InChI Key:
SARHWEGXARRGDZ-UHFFFAOYSA-N
SMILES:
Cc1cc2[nH]c(nc2cc1C)C(=O)C
Properties
Complexity:
241
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
188.095g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
188.23g/mol
Monoisotopic Mass:
188.095g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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