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3,3',3'',3'''-silanetetrayltetrakis-Benzoic acid

Catalog Number
ACM31825577-1
CAS Number
31825-57-7
Product Name
3,3',3'',3'''-silanetetrayltetrakis-Benzoic acid
Category
Carboxylic acid MOF ligand-tetracarboxylic acid MOF ligand
IUPAC Name
3-tris(3-carboxyphenyl)silylbenzoic acid
Molecular Weight
512.5g/mol
Molecular Formula
C28H20O8Si
InChI
InChI=1S/C28H20O8Si/c29-25(30)17-5-1-9-21(13-17)37(22-10-2-6-18(14-22)26(31)32,23-11-3-7-19(15-23)27(33)34)24-12-4-8-20(16-24)28(35)36/h1-16H,(H,29,30)(H,31,32)(H,33,34)(H,35,36)
InChI Key
TXYNHBNNPJZOEA-UHFFFAOYSA-N
Complexity
733
Compound Is Canonicalized
Yes
Covalently-Bonded Unit Count
1
Defined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Exact Mass
512.09274413g/mol
Formal Charge
0
Heavy Atom Count
37
Hydrogen Bond Acceptor Count
8
Hydrogen Bond Donor Count
4
Isotope Atom Count
0
Monoisotopic Mass
512.09274413g/mol
Rotatable Bond Count
8
Topological Polar Surface Area
149Ų
Undefined Atom Stereocenter Count
0
Undefined Bond Stereocenter Count
0
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