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MOFs and COFs Compound

Carboxylic acid MOF ligand-dicarboxylic acid MOF ligand

9,10-Anthracenedicarboxylic acid

9,10-Anthracenedicarboxylic acid

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Catalog Number

ACM73016087-1

CAS Number

73016-08-7

Product Name

9,10-Anthracenedicarboxylic acid

Category

Carboxylic acid MOF ligand-dicarboxylic acid MOF ligand

Synonyms

H2ADC

Description

9,10-Anthracenedicarboxylic acid (H2L) is an anthracene based dicarboxylic compound, which has a larger conjugating π-system that enables the development of fluorescent materials. It has interesting magnetic and luminescent properties. It can be used as a bridging carboxylic acid ligand with a steric bulk due to the presence of its anthracene ring.

IUPAC Name

anthracene-9,10-dicarboxylic acid

Molecular Weight

266.25

Molecular Formula

C16H10O4

Canonical SMILES

C1=CC=C2C(=C1)C(=C3C=CC=CC3=C2C(=O)O)C(=O)O

InChI

1S/C16H10O4/c17-15(18)13-9-5-1-2-6-10(9)14(16(19)20)12-8-4-3-7-11(12)13/h1-8H,(H,17,18)(H,19,20)

InChI Key

FDFGHPKPHFUHBP-UHFFFAOYSA-N

Boiling Point

>300 °C

Melting Point

>300 °C

Flash Point

Not applicable

Purity

96%

Appearance

Yellow solid

Complexity

343

Compound Is Canonicalized

Yes

Covalently-Bonded Unit Count

1

Defined Atom Stereocenter Count

0

Defined Bond Stereocenter Count

0

Exact Mass

266.05790880g/mol

Formal Charge

0

Heavy Atom Count

20

Hydrogen Bond Acceptor Count

4

Hydrogen Bond Donor Count

2

Isotope Atom Count

0

MDL Number

MDLnumberMFCD00229428

Monoisotopic Mass

266.05790880g/mol

Rotatable Bond Count

2

Topological Polar Surface Area

74.6Å²

Undefined Atom Stereocenter Count

0

Undefined Bond Stereocenter Count

0

XLogP3

3.4

MSDS

COA

Spec Sheet

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