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Home > Imidazoles > 89372-28-1
89372-28-1 | 1H-Imidazole, 1-(2-methyl-1-oxo-2-phenylpropyl)-
CAS No: 89372-28-1 Catalog No: AG003XKG MDL No:
Product Description
Catalog Number:
AG003XKG
Chemical Name:
1H-Imidazole, 1-(2-methyl-1-oxo-2-phenylpropyl)-
CAS Number:
89372-28-1
Molecular Formula:
C13H14N2O
Molecular Weight:
214.2631
IUPAC Name:
1-imidazol-1-yl-2-methyl-2-phenylpropan-1-one
InChI:
InChI=1S/C13H14N2O/c1-13(2,11-6-4-3-5-7-11)12(16)15-9-8-14-10-15/h3-10H,1-2H3
InChI Key:
SWGBHPSSNZWROV-UHFFFAOYSA-N
SMILES:
O=C(C(c1ccccc1)(C)C)n1cncc1
Properties
Complexity:
257
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
214.111g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
214.268g/mol
Monoisotopic Mass:
214.111g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
34.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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