CAS 63557-10-8 4,4',4''-((1,3,5-triazine-2,4,6-triyl)tris(azanediyl))tribenzoic acid

NAVIGATION

4,4',4''-((1,3,5-triazine-2,4,6-triyl)tris(azanediyl))tribenzoic acid

PRICE INQUIRY

Catalog Number

ACM63557108-2

CAS Number

63557-10-8

Product Name

4,4',4''-((1,3,5-triazine-2,4,6-triyl)tris(azanediyl))tribenzoic acid

Structure

Category

Carboxylic acid MOF ligand-tricarboxylic acid MOF ligand

IUPAC Name

4-[[4,6-bis(4-carboxyanilino)-1,3,5-triazin-2-yl]amino]benzoic acid

Molecular Weight

486.4g/mol

Molecular Formula

C24H18N6O6

InChI

InChI=1S/C24H18N6O6/c31-19(32)13-1-7-16(8-2-13)25-22-28-23(26-17-9-3-14(4-10-17)20(33)34)30-24(29-22)27-18-11-5-15(6-12-18)21(35)36/h1-12H,(H,31,32)(H,33,34)(H,35,36)(H3,25,26,27,28,29,30)

InChI Key

NGJJZCPADSICRI-UHFFFAOYSA-N

Complexity

650

Compound Is Canonicalized

Yes

Covalently-Bonded Unit Count

Defined Atom Stereocenter Count

Defined Bond Stereocenter Count

Exact Mass

486.12878232g/mol

Formal Charge

Heavy Atom Count

Hydrogen Bond Acceptor Count

Hydrogen Bond Donor Count

Isotope Atom Count

Monoisotopic Mass

486.12878232g/mol

Rotatable Bond Count

Topological Polar Surface Area

187Å²

Undefined Atom Stereocenter Count

Undefined Bond Stereocenter Count

XLogP3

4.2

MSDS

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COA

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Spec Sheet

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