2',3',5',6'-tetramethyl-[1,1':4',1''-terphenyl]-3,3'',5,5''-tetracarboxylic acid

Name: 2',3',5',6'-tetramethyl-[1,1':4',1''-terphenyl]-3,3'',5,5''-tetracarboxylic acid
SKU: ACM1119195991-1
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Catalog NumberACM1119195991-1

CAS Number1119195-99-1

CategoryCustomizable MOF Linkers

IUPAC Name

5-[4-(3,5-dicarboxyphenyl)-2,3,5,6-tetramethylphenyl]benzene-1,3-dicarboxylic acid

Molecular Weight

462.4g/mol

Molecular Formula

C26H22O8

InChI

InChI=1S/C26H22O8/c1-11-12(2)22(16-7-19(25(31)32)10-20(8-16)26(33)34)14(4)13(3)21(11)15-5-17(23(27)28)9-18(6-15)24(29)30/h5-10H,1-4H3,(H,27,28)(H,29,30)(H,31,32)(H,33,34)

InChI Key

SJOTYMPLFGUFCB-UHFFFAOYSA-N

Complexity

683

Compound Is Canonicalized

Yes

Covalently-Bonded Unit Count

Defined Atom Stereocenter Count

Defined Bond Stereocenter Count

Exact Mass

462.13146766g/mol

Formal Charge

Heavy Atom Count

Hydrogen Bond Acceptor Count

Hydrogen Bond Donor Count

Isotope Atom Count

Monoisotopic Mass

462.13146766g/mol

Rotatable Bond Count

Topological Polar Surface Area

149Å²

Undefined Atom Stereocenter Count

Undefined Bond Stereocenter Count

XLogP3

4.7

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