CAS 1337923-87-1 5, 5'- (9, 10- anthracenediyldi- 2, 1- ethynediyl) bis-isophthalic acid

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5, 5'- (9, 10- anthracenediyldi- 2, 1- ethynediyl) bis-isophthalic acid

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Catalog Number

ACM1337923871

CAS Number

1337923-87-1

Product Name

5, 5'- (9, 10- anthracenediyldi- 2, 1- ethynediyl) bis-isophthalic acid

Category

Customizable MOF Linkers

IUPAC Name

5-[2-[10-[2-(3,5-dicarboxyphenyl)ethynyl]anthracen-9-yl]ethynyl]benzene-1,3-dicarboxylic acid

Molecular Weight

554.5

Molecular Formula

C34H18O8

InChI

InChI=1S/C34H18O8/c35-31(36)21-13-19(14-22(17-21)32(37)38)9-11-29-25-5-1-2-6-26(25)30(28-8-4-3-7-27(28)29)12-10-20-15-23(33(39)40)18-24(16-20)34(41)42/h1-8,13-18H,(H,35,36)(H,37,38)(H,39,40)(H,41,42)

InChI Key

SRAGFZDNJDDTLM-UHFFFAOYSA-N

Purity

98%

Complexity

1050

Compound Is Canonicalized

Yes

Covalently-Bonded Unit Count

Defined Atom Stereocenter Count

Defined Bond Stereocenter Count

Exact Mass

554.10016753g/mol

Formal Charge

Heavy Atom Count

Hydrogen Bond Acceptor Count

Hydrogen Bond Donor Count

Isotope Atom Count

Monoisotopic Mass

554.10016753g/mol

Rotatable Bond Count

Topological Polar Surface Area

149Å²

Undefined Atom Stereocenter Count

Undefined Bond Stereocenter Count

XLogP3

6.6

MSDS

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COA

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Spec Sheet

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