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114707-42-5 | 1H-Imidazole, 1-(2-benzofuranylphenylmethyl)-
CAS No: 114707-42-5 Catalog No: AG000F2X MDL No:
Product Description
Catalog Number:
AG000F2X
Chemical Name:
1H-Imidazole, 1-(2-benzofuranylphenylmethyl)-
CAS Number:
114707-42-5
Molecular Formula:
C18H14N2O
Molecular Weight:
274.3166
IUPAC Name:
1-[[2-(1-benzofuran-2-yl)phenyl]methyl]imidazole
InChI:
InChI=1S/C18H14N2O/c1-3-7-16(15(6-1)12-20-10-9-19-13-20)18-11-14-5-2-4-8-17(14)21-18/h1-11,13H,12H2
InChI Key:
YZNMIMIKWJKTTI-UHFFFAOYSA-N
SMILES:
c1ncn(c1)Cc1ccccc1c1cc2c(o1)cccc2
Properties
Complexity:
348
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
274.111g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
274.323g/mol
Monoisotopic Mass:
274.111g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
31A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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