CAS 4546-95-6 1,2,3-Triazole-4,5-dicarboxylic acid

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MOFs and COFs Compound

MOF&COF-Ligand

1,2,3-Triazole-4,5-dicarboxylic acid

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Catalog Number

ACM4546956-2

Product Name

1,2,3-Triazole-4,5-dicarboxylic acid

Structure

CAS

4546-95-6

Category

MOF&COF-Ligand

Synonyms

1H-1,2,3-Triazole-4,5-Dicarboxylic Acid; 2H-triazole-4,5-dicarboxylic acid

IUPAC Name

2H-triazole-4,5-dicarboxylic acid

Molecular Weight

157.08

Molecular Formula

C4H3N3O4

InChI

InChI=1S/C4H3N3O4/c8-3(9)1-2(4(10)11)6-7-5-1/h(H,8,9)(H,10,11)(H,5,6,7)

InChI Key

TZFOEYRGARRRGO-UHFFFAOYSA-N

Purity

97%

Appearance

White solid

Complexity

174

Compound Is Canonicalized

Yes

Covalently-Bonded Unit Count

Defined Atom Stereocenter Count

Defined Bond Stereocenter Count

Exact Mass

157.01235559g/mol

Formal Charge

Heavy Atom Count

Hydrogen Bond Acceptor Count

Hydrogen Bond Donor Count

Isotope Atom Count

Monoisotopic Mass

157.01235559g/mol

NSC Number

83126

Rotatable Bond Count

Topological Polar Surface Area

116Å²

Undefined Atom Stereocenter Count

Undefined Bond Stereocenter Count

XLogP3

-0.7

MSDS

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COA

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Spec Sheet

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