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Diethyl 3,5-di-tert-butyl-4-hydroxybenzyl phosphate

Diethyl 3,5-di-tert-butyl-4-hydroxybenzyl phosphate

Inquiry

Molecular Formula:

C19H33O4P

Molecular Weight:

356.44

CAS Number:

976-56-7

Catalog Number:

976-56-7

Product Information

Molecular Formula:

C19H33O4P

Molecular Weight:

356.44

Description

Diethyl 3,5-di-tert-butyl-4-hydroxybenzyl phosphate is a robust antioxidant employed in the biomedical domain. It showcases extraordinary efficacy in counteracting free radicals, effectively mitigating oxidative stress and thwarting cellular harm. Renowned for its immense therapeutic capabilities, this compound finds extensive application in the formulation of pharmacological agents, specifically designed to combat diverse maladies that stem from oxidative stress, encompassing neurodegenerative ailments, cardiovascular afflictions, and malignancies.

Synonyms

[[3,5-bis(1,1-dimethylethyl)-4-hydroxyphenyl]methyl]-phosphonicacidiethyl; Diethyl3,5-di-tert-buty-4-hydroxy-ben-zylphosphonate; Irganox1222; Phosphonicacid,[[3,5-bis(1,1-dimethylethyl)-4-hydroxyphenyl]methyl]-,diethylester; diethyl 3,5-di-tert-butyl-4-hydro

IUPAC Name

2,6-ditert-butyl-4-(diethoxyphosphorylmethyl)phenol

Canonical SMILES

CCOP(=O)(CC1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C)OCC

InChI

InChI=1S/C19H33O4P/c1-9-22-24(21,23-10-2)13-14-11-15(18(3,4)5)17(20)16(12-14)19(6,7)8/h11-12,20H,9-10,13H2,1-8H3

InChI Key

GJDRKHHGPHLVNI-UHFFFAOYSA-N

Melting Point

122 °C

Purity

>98.0%(HPLC)

Density

1.046g/cm3

Appearance

White to Almost white powder to crystal

Computed Properties

XLogP3

4.7

Hydrogen Bond Donor Count

Hydrogen Bond Acceptor Count

Rotatable Bond Count

Exact Mass

356.21164653 g/mol

Monoisotopic Mass

356.21164653 g/mol

Topological Polar Surface Area

55.8Å²

Heavy Atom Count

Formal Charge

Complexity

402

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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Diethyl 3,5-di-tert-butyl-4-hydroxybenzyl phosphate

Product Information

Computed Properties

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