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2,2''-Dimethyl-[1,1':4',1''-terphenyl]-4,4''-dicarboxylic acid

Name: 2,2''-Dimethyl-[1,1':4',1''-terphenyl]-4,4''-dicarboxylic acid
SKU: ACM1807547392-1
Rating: 5 (1 reviews)

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Catalog NumberACM1807547392-1

CAS Number1807547-39-2

CategoryCarboxylic acid MOF ligand-tricarboxylic acid MOF ligand

Synonyms

2,4,6-Tri(1H-imidazol-1-yl)-1,3,5-triazine; timtz

IUPAC Name

4-[4-(4-carboxy-2-methylphenyl)phenyl]-3-methylbenzoic acid

Molecular Weight

346.38

Molecular Formula

C22H18O4

InChI

InChI=1S/C22H18O4/c1-13-11-17(21(23)24)7-9-19(13)15-3-5-16(6-4-15)20-10-8-18(22(25)26)12-14(20)2/h3-12H,1-2H3,(H,23,24)(H,25,26)

InChI Key

FQIBTEMKVHZJKB-UHFFFAOYSA-N

Purity

95%

Appearance

White powder

Complexity

462

Compound Is Canonicalized

Yes

Covalently-Bonded Unit Count

Defined Atom Stereocenter Count

Defined Bond Stereocenter Count

Exact Mass

346.12050905g/mol

Formal Charge

Heavy Atom Count

Hydrogen Bond Acceptor Count

Hydrogen Bond Donor Count

Isotope Atom Count

Monoisotopic Mass

346.12050905g/mol

Rotatable Bond Count

Topological Polar Surface Area

74.6Å²

Undefined Atom Stereocenter Count

Undefined Bond Stereocenter Count

XLogP3

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