CAS 1359740-23-0 4,4'-[[2-[(4-carboxyphenoxy)methyl]-2-ethylpropane-1,3-diyl]dioxy]dibenzoic acid

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4,4'-[[2-[(4-carboxyphenoxy)methyl]-2-ethylpropane-1,3-diyl]dioxy]dibenzoic acid

PRICE INQUIRY

Catalog Number

ACM1359740230-1

CAS Number

1359740-23-0

Product Name

4,4'-[[2-[(4-carboxyphenoxy)methyl]-2-ethylpropane-1,3-diyl]dioxy]dibenzoic acid

Category

Carboxylic acid MOF ligand-tricarboxylic acid MOF ligand

IUPAC Name

4-[2,2-bis[(4-carboxyphenoxy)methyl]butoxy]benzoic acid

Molecular Weight

494.5g/mol

Molecular Formula

C27H26O9

InChI

InChI=1S/C27H26O9/c1-2-27(15-34-21-9-3-18(4-10-21)24(28)29,16-35-22-11-5-19(6-12-22)25(30)31)17-36-23-13-7-20(8-14-23)26(32)33/h3-14H,2,15-17H2,1H3,(H,28,29)(H,30,31)(H,32,33)

InChI Key

JQXNOSZNYSTYCJ-UHFFFAOYSA-N

Complexity

622

Compound Is Canonicalized

Yes

Covalently-Bonded Unit Count

Defined Atom Stereocenter Count

Defined Bond Stereocenter Count

Exact Mass

494.15768240g/mol

Formal Charge

Heavy Atom Count

Hydrogen Bond Acceptor Count

Hydrogen Bond Donor Count

Isotope Atom Count

Monoisotopic Mass

494.15768240g/mol

Rotatable Bond Count

Topological Polar Surface Area

140Å²

Undefined Atom Stereocenter Count

Undefined Bond Stereocenter Count

XLogP3

4.8

MSDS

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COA

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Spec Sheet

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