TRIALLYL 1,3,5-BENZENETRICARBOXYLATE

Inquiry

Molecular Formula:

C18H18O6

Molecular Weight:

330.33

CAS Number:

17832-16-5

Catalog Number:

17832-16-5

Product Information

Molecular Formula:

C18H18O6

Molecular Weight:

330.33

Description

TRIALLYL 1,3,5-BENZENETRICARBOXYLATE is a prominent chemical compound extensively employed in the biomedical sector. It showcases remarkable prospects in combating an assortment of ailments encompassing cancer, inflammation, and oxidative stress-related disorders.

Synonyms

1,3,5-BENZENETRICARBOXYLIC ACID TRIALLYL ESTER; TRIMESIC ACID TRIALLYL ESTER; TRIALLYL 1,3,5-BENZENETRICARBOXYLATE; TRIALLYL TRIMESATE; triallyl benzene-1,3,5-tricarboxylate; TRIALLYL 1,3,5-BENZENETRICARBOXYLATE, 98 %

IUPAC Name

tris(prop-2-enyl) benzene-1,3,5-tricarboxylate

Canonical SMILES

C=CCOC(=O)C1=CC(=CC(=C1)C(=O)OCC=C)C(=O)OCC=C

InChI

InChI=1S/C18H18O6/c1-4-7-22-16(19)13-10-14(17(20)23-8-5-2)12-15(11-13)18(21)24-9-6-3/h4-6,10-12H,1-3,7-9H2

InChI Key

VOSUIKFOFHZNED-UHFFFAOYSA-N

Boiling Point

175-190°C0.1 mm Hg(lit.)

Melting Point

31-34°C(lit.)

Flash Point

>230 °F

Purity

95%

Density

1.16

Appearance

White or Colorless to Light yellow powder to lump to clear liquid

Refractive Index

1.5200 (estimate)

Computed Properties

XLogP3

3.4

Hydrogen Bond Donor Count

Hydrogen Bond Acceptor Count

Rotatable Bond Count

Exact Mass

330.11033829 g/mol

Monoisotopic Mass

330.11033829 g/mol

Topological Polar Surface Area

78.9Å²

Heavy Atom Count

Formal Charge

Complexity

412

Isotope Atom Count

Defined Atom Stereocenter Count

Undefined Atom Stereocenter Count

Defined Bond Stereocenter Count

Undefined Bond Stereocenter Count

Covalently-Bonded Unit Count

Compound Is Canonicalized

Yes

The molarity calculator equation

Mass (g) = Concentration (mol/L) × Volume (L) × Molecular Weight (g/mol)

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The dilution calculator equation

Concentration _(start) × Volume _(start) = Concentration _(final) × Volume _(final)

This equation is commonly abbreviated as: C₁V₁ = C₂V₂

Concentration _(start)

Volume _(start)

Concentration _(final)

Volume _(final)

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TRIALLYL 1,3,5-BENZENETRICARBOXYLATE

Product Information

Computed Properties

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