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2654-31-1 | 1H-Imidazole, 4-methyl-2,5-diphenyl-
CAS No: 2654-31-1 Catalog No: AG002TMP MDL No:
Product Description
Catalog Number:
AG002TMP
Chemical Name:
1H-Imidazole, 4-methyl-2,5-diphenyl-
CAS Number:
2654-31-1
Molecular Formula:
C16H14N2
Molecular Weight:
234.2958
IUPAC Name:
5-methyl-2,4-diphenyl-1H-imidazole
InChI:
InChI=1S/C16H14N2/c1-12-15(13-8-4-2-5-9-13)18-16(17-12)14-10-6-3-7-11-14/h2-11H,1H3,(H,17,18)
InChI Key:
WELZFURMIFFATQ-UHFFFAOYSA-N
SMILES:
Cc1nc([nH]c1c1ccccc1)c1ccccc1
Properties
Complexity:
254
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.116g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
234.302g/mol
Monoisotopic Mass:
234.116g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
28.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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