DIMETHYL OCTADECANEDIOATE

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Molecular Formula:

C20H38O4

Molecular Weight:

342.51

CAS Number:

1472-93-1

Catalog Number:

1472-93-1

Product Information

Molecular Formula:

C20H38O4

Molecular Weight:

342.51

Description

Dimethyl Octadecanedioate is a chemical compound used in the biomedical industry. It possesses various pharmacological properties and is commonly used in the formulation of drugs for treating skin conditions like eczema, psoriasis, and dermatitis. Additionally, it is utilized as an ingredient in the production of cosmetics and personal care products due to its emollient and moisturizing properties.

Synonyms

DIMETHYL OCTADECANEDIOATE; octadecanedioic acid,dimethyl ester

IUPAC Name

dimethyl octadecanedioate

Canonical SMILES

COC(=O)CCCCCCCCCCCCCCCCC(=O)OC

InChI

InChI=1S/C20H38O4/c1-23-19(21)17-15-13-11-9-7-5-3-4-6-8-10-12-14-16-18-20(22)24-2/h3-18H2,1-2H3

InChI Key

ZOXMHKCFDXHCJX-UHFFFAOYSA-N

Boiling Point

207ºC / 3mmHg

Melting Point

60ºC

Purity

95%

Density

0.936g/cm3

Appearance

White to Almost white powder to crystal

Computed Properties

XLogP3

7.3

Hydrogen Bond Donor Count

Hydrogen Bond Acceptor Count

Rotatable Bond Count

Exact Mass

342.27700969 g/mol

Monoisotopic Mass

342.27700969 g/mol

Topological Polar Surface Area

52.6Å²

Heavy Atom Count

Formal Charge

Complexity

272

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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Concentration _(final)

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DIMETHYL OCTADECANEDIOATE

Product Information

Computed Properties

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