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1,2,4,5-Tetrakis(4-carboxyphenyl)benzene

Catalog Number
ACM1078153588-1
CAS Number
1078153-58-8
Product Name
1,2,4,5-Tetrakis(4-carboxyphenyl)benzene
Category
Carboxylic acid MOF ligand-tetracarboxylic acid MOF ligand
Synonyms
H4TCPB
IUPAC Name
4-[2,4,5-tris(4-carboxyphenyl)phenyl]benzoic acid
Molecular Weight
558.53
Molecular Formula
C34H22O8
InChI
InChI=1S/C34H22O8/c35-31(36)23-9-1-19(2-10-23)27-17-29(21-5-13-25(14-6-21)33(39)40)30(22-7-15-26(16-8-22)34(41)42)18-28(27)20-3-11-24(12-4-20)32(37)38/h1-18H,(H,35,36)(H,37,38)(H,39,40)(H,41,42)
InChI Key
SRTQKANXPMBQCX-UHFFFAOYSA-N
Purity
95%
Appearance
Pale yellow powder
Complexity
808
Compound Is Canonicalized
Yes
Covalently-Bonded Unit Count
1
Defined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Exact Mass
558.13146766g/mol
Formal Charge
0
Heavy Atom Count
42
Hydrogen Bond Acceptor Count
8
Hydrogen Bond Donor Count
4
Isotope Atom Count
0
Monoisotopic Mass
558.13146766g/mol
Rotatable Bond Count
8
Topological Polar Surface Area
149Ų
Undefined Atom Stereocenter Count
0
Undefined Bond Stereocenter Count
0
XLogP3
6.5
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