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4-(1h-imidazol-2-yl)benzoic Acid

Catalog Number
ACMA00021457
Product Name
4-(1h-imidazol-2-yl)benzoic Acid
Category
MOF&COF-Ligand
IUPAC Name
4-(1H-imidazol-2-yl)benzoic acid
Molecular Weight
188.18g/mol
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
Complexity
212
Compound Is Canonicalized
Yes
Covalently-Bonded Unit Count
1
Defined Atom Stereocenter Count
0
Defined Bond 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
Isotope Atom Count
0
Monoisotopic Mass
188.058577502g/mol
Rotatable Bond Count
2
Topological Polar Surface Area
66Ų
Undefined Atom Stereocenter Count
0
Undefined Bond Stereocenter Count
0
XLogP3
1.4
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