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88427-06-9 | 1H-Imidazole, 1-(3-bromo-2,3-diphenyl-2-propenyl)-
CAS No: 88427-06-9 Catalog No: AG004ESK MDL No:
Product Description
Catalog Number:
AG004ESK
Chemical Name:
1H-Imidazole, 1-(3-bromo-2,3-diphenyl-2-propenyl)-
CAS Number:
88427-06-9
Molecular Formula:
C18H15BrN2
Molecular Weight:
339.2291
IUPAC Name:
1-(3-bromo-2,3-diphenylprop-2-enyl)imidazole
InChI:
InChI=1S/C18H15BrN2/c19-18(16-9-5-2-6-10-16)17(13-21-12-11-20-14-21)15-7-3-1-4-8-15/h1-12,14H,13H2
InChI Key:
YRHDHYKOURZHCQ-UHFFFAOYSA-N
SMILES:
BrC(=C(c1ccccc1)Cn1cncc1)c1ccccc1
Properties
Complexity:
354
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
338.042g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
339.236g/mol
Monoisotopic Mass:
338.042g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
17.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
4.6
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