Pentaerythritol tetrakis(2-mercaptoacetate)

Inquiry

Molecular Formula:

C13H20O8S4

Molecular Weight:

432.55

CAS Number:

10193-99-4

Catalog Number:

10193-99-4

Product Information

Molecular Formula:

C13H20O8S4

Molecular Weight:

432.55

Description

Pentaerythritol tetrakis(2-mercaptoacetate) is an invaluable compound extensively utilized in the biomedical sphere. It exhibits remarkable antioxidant characteristics and finds application in diverse disease and condition treatments, showcasing its pivotal role in counteracting oxidative stress and eliminating pernicious free radicals. By doing so, this product aids in ameliorating drug-resistant malignancies and neurological degenerative ailments.

Synonyms

PENTAERYTHRITOL TETRAKIS(2-MERCAPTOACETATE); PENTAERYTHRITOL TETRATHIOGLYCOLATE; PENTAERYTHRITOL TETRAKIS(MERCAPTOACETATE); PENTAERYTHRITOL TETRA(MERCAPTOACETATE); ACETIC ACID, MERCAPTO-, 2,2-BIS [[(MERCAPTOACETYL) OXY] METHYL] -1,3-PROPANEDIYL ESTER; acetica

IUPAC Name

[3-(2-sulfanylacetyl)oxy-2,2-bis[(2-sulfanylacetyl)oxymethyl]propyl] 2-sulfanylacetate

Canonical SMILES

C(C(=O)OCC(COC(=O)CS)(COC(=O)CS)COC(=O)CS)S

InChI

InChI=1S/C13H20O8S4/c14-9(1-22)18-5-13(6-19-10(15)2-23,7-20-11(16)3-24)8-21-12(17)4-25/h22-25H,1-8H2

InChI Key

RUDUCNPHDIMQCY-UHFFFAOYSA-N

Boiling Point

250°C (1 mmHg)

Flash Point

113 °C (C.C)

Purity

111.0117.0(SH equiv.)

Density

1.385

Appearance

Colorless to Almost colorless clear liquid

Refractive Index

1.5470

Safety Information

Hazards

H315 H319 H335

Precautionary Statement

P261 P305+P351+P338

Computed Properties

XLogP3

1.2

Hydrogen Bond Donor Count

Hydrogen Bond Acceptor Count

Rotatable Bond Count

Exact Mass

432.00410229 g/mol

Monoisotopic Mass

432.00410229 g/mol

Topological Polar Surface Area

109Å²

Heavy Atom Count

Formal Charge

Complexity

385

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

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Pentaerythritol tetrakis(2-mercaptoacetate)

Product Information

Safety Information

Computed Properties

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