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Home > Bromides > 1141669-55-7
1141669-55-7 | Ethanone, 1-[3-bromo-4-(1H-imidazol-1-yl)phenyl]-
CAS No: 1141669-55-7 Catalog No: AG000APS MDL No:MFCD11656809
Product Description
Catalog Number:
AG000APS
Chemical Name:
Ethanone, 1-[3-bromo-4-(1H-imidazol-1-yl)phenyl]-
CAS Number:
1141669-55-7
Molecular Formula:
C11H9BrN2O
Molecular Weight:
265.1060
MDL Number:
MFCD11656809
IUPAC Name:
1-(3-bromo-4-imidazol-1-ylphenyl)ethanone
InChI:
InChI=1S/C11H9BrN2O/c1-8(15)9-2-3-11(10(12)6-9)14-5-4-13-7-14/h2-7H,1H3
InChI Key:
YXCHZUPKBMZDGO-UHFFFAOYSA-N
SMILES:
Brc1cc(ccc1n1cncc1)C(=O)C
Properties
Complexity:
247
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
263.99g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
265.11g/mol
Monoisotopic Mass:
263.99g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
34.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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