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136350-71-5 | 1H-Imidazole, 5-(4-bromophenyl)-1-methyl-
CAS No: 136350-71-5 Catalog No: AG0011S8 MDL No:MFCD18375271
Product Description
Catalog Number:
AG0011S8
Chemical Name:
1H-Imidazole, 5-(4-bromophenyl)-1-methyl-
CAS Number:
136350-71-5
Molecular Formula:
C10H9BrN2
Molecular Weight:
237.0959
MDL Number:
MFCD18375271
IUPAC Name:
5-(4-bromophenyl)-1-methylimidazole
InChI:
InChI=1S/C10H9BrN2/c1-13-7-12-6-10(13)8-2-4-9(11)5-3-8/h2-7H,1H3
InChI Key:
GBRRZXCIOPPVND-UHFFFAOYSA-N
SMILES:
Brc1ccc(cc1)c1cncn1C
Properties
Complexity:
166
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
235.995g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
237.1g/mol
Monoisotopic Mass:
235.995g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
17.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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