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Home > Imidazoles > 13745-27-2
13745-27-2 | Methanone, (1-methyl-1H-benzimidazol-2-yl)-4-pyridinyl-
CAS No: 13745-27-2 Catalog No: AG0013AB MDL No:MFCD18432529
Product Description
Catalog Number:
AG0013AB
Chemical Name:
Methanone, (1-methyl-1H-benzimidazol-2-yl)-4-pyridinyl-
CAS Number:
13745-27-2
Molecular Formula:
C14H11N3O
Molecular Weight:
237.2566
MDL Number:
MFCD18432529
IUPAC Name:
(1-methylbenzimidazol-2-yl)-pyridin-4-ylmethanone
InChI:
InChI=1S/C14H11N3O/c1-17-12-5-3-2-4-11(12)16-14(17)13(18)10-6-8-15-9-7-10/h2-9H,1H3
InChI Key:
HNENKHQVZSBINL-UHFFFAOYSA-N
SMILES:
O=C(c1nc2c(n1C)cccc2)c1ccncc1
Properties
Complexity:
314
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
237.09g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
237.262g/mol
Monoisotopic Mass:
237.09g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
47.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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