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quarterphenyl- 3, 3''', 5, 5'''- tetracarboxylic acid

Catalog Number
ACM921619912-1
CAS Number
921619-91-2
Product Name
quarterphenyl- 3, 3''', 5, 5'''- tetracarboxylic acid
Category
Carboxylic acid MOF ligand-tetracarboxylic acid MOF ligand
IUPAC Name
5-[4-[4-(3,5-dicarboxyphenyl)phenyl]phenyl]benzene-1,3-dicarboxylic acid
Molecular Weight
482.4g/mol
Molecular Formula
C28H18O8
InChI
InChI=1S/C28H18O8/c29-25(30)21-9-19(10-22(13-21)26(31)32)17-5-1-15(2-6-17)16-3-7-18(8-4-16)20-11-23(27(33)34)14-24(12-20)28(35)36/h1-14H,(H,29,30)(H,31,32)(H,33,34)(H,35,36)
InChI Key
UMTUQDSLNCYCDQ-UHFFFAOYSA-N
Appearance
921619-91-2
Complexity
711
Compound Is Canonicalized
Yes
Covalently-Bonded Unit Count
1
Defined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Exact Mass
482.10016753g/mol
Formal Charge
0
Heavy Atom Count
36
Hydrogen Bond Acceptor Count
8
Hydrogen Bond Donor Count
4
Isotope Atom Count
0
Monoisotopic Mass
482.10016753g/mol
Rotatable Bond Count
7
Topological Polar Surface Area
149Ų
Undefined Atom Stereocenter Count
0
Undefined Bond Stereocenter Count
0
XLogP3
4.9
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