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4-(1H-Imidazol-2-yl)benzoic acid

Catalog Number ACM108035456-1
CAS 108035-45-6
Structure 4-(1H-Imidazol-2-yl)benzoic acid
Synonyms Benzoicacid,4-(1H-imidazol-2-yl)-; 4-(Imidazol-2-yl)benzoic acid
IUPAC Name 4-(1H-imidazol-2-yl)benzoic acid
Molecular Weight 188.18
Molecular Formula C10H8N2O2
InChI InChI=1S/C10H8N2O2/c13-10(14)8-3-1-7(2-4-8)9-11-5-6-12-9/h1-6H,(H,11,12)(H,13,14)
InChI Key YJCYHGYOXHANSY-UHFFFAOYSA-N
Boiling Point >350 °C
Melting Point >350 °C
Purity 97%
Complexity 212
Covalently-Bonded Unit Count 1
Defined Atom Stereocenter Count 0
Exact Mass 188.058577502g/mol
Formal Charge 0
Heavy Atom Count 14
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 2
Monoisotopic Mass 188.058577502g/mol
Rotatable Bond Count 2
Topological Polar Surface Area 66Ų

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