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3,3″-Diamino-1,1':4',1″-terphenyl-4,4″-dicarboxylate

Catalog Number
ACM2101636513-2
Product Name
3,3″-Diamino-1,1':4',1″-terphenyl-4,4″-dicarboxylate
CAS
2101636-51-3
Category
Carboxylic acid MOF ligand-dicarboxylic acid MOF ligand
Synonyms
2-Amino-4-[4-(3-amino-4-carboxyphenyl)phenyl]benzoic acid ; NH2-TPDC
IUPAC Name
2-amino-4-[4-(3-amino-4-carboxyphenyl)phenyl]benzoic acid
Molecular Weight
348.35
Molecular Formula
C20H16N2O4
InChI
InChI=1S/C20H16N2O4/c21-17-9-13(5-7-15(17)19(23)24)11-1-2-12(4-3-11)14-6-8-16(20(25)26)18(22)10-14/h1-10H,21-22H2,(H,23,24)(H,25,26)
InChI Key
TVJAEPMTJSNWLY-UHFFFAOYSA-N
Purity
97%
Appearance
Soild
Complexity
472
Compound Is Canonicalized
Yes
Covalently-Bonded Unit Count
1
Defined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Exact Mass
348.11100700g/mol
Formal Charge
0
Heavy Atom Count
26
Hydrogen Bond Acceptor Count
6
Hydrogen Bond Donor Count
4
Isotope Atom Count
0
Monoisotopic Mass
348.11100700g/mol
Rotatable Bond Count
4
Topological Polar Surface Area
127Ų
Undefined Atom Stereocenter Count
0
Undefined Bond Stereocenter Count
0
XLogP3
4
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