CAS 1815596-32-7 4,4'-(4-Amino-4H-1,2,4-triazole-3,5-diyl)dibenzoic acid

NAVIGATION

4,4'-(4-Amino-4H-1,2,4-triazole-3,5-diyl)dibenzoic acid

PRICE INQUIRY

Catalog Number

ACM1815596327-1

CAS Number

1815596-32-7

Product Name

4,4'-(4-Amino-4H-1,2,4-triazole-3,5-diyl)dibenzoic acid

Category

Carboxylic acid MOF ligand-dicarboxylic acid MOF ligand

Synonyms

H2atdbc

IUPAC Name

4-[4-amino-5-(4-carboxyphenyl)-1,2,4-triazol-3-yl]benzoic acid

Molecular Weight

324.29

Molecular Formula

C16H12N4O4

InChI

InChI=1S/C16H12N4O4/c17-20-13(9-1-5-11(6-2-9)15(21)22)18-19-14(20)10-3-7-12(8-4-10)16(23)24/h1-8H,17H2,(H,21,22)(H,23,24)

InChI Key

YEGGBYRIRLOQOP-UHFFFAOYSA-N

Purity

98%

Appearance

White powder

Complexity

431

Compound Is Canonicalized

Yes

Covalently-Bonded Unit Count

Defined Atom Stereocenter Count

Defined Bond Stereocenter Count

Exact Mass

324.08585488g/mol

Formal Charge

Heavy Atom Count

Hydrogen Bond Acceptor Count

Hydrogen Bond Donor Count

Isotope Atom Count

Monoisotopic Mass

324.08585488g/mol

Rotatable Bond Count

Topological Polar Surface Area

131Å²

Undefined Atom Stereocenter Count

Undefined Bond Stereocenter Count

XLogP3

1.6

MSDS

Download MSDS

COA

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Spec Sheet

Download Spec Sheet

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