P-PHENYLENEDIPROPIONIC ACID

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Molecular Formula:

C12H14O4

Molecular Weight:

222.24

CAS Number:

4251-21-2

Catalog Number:

4251-21-2

Product Information

Molecular Formula:

C12H14O4

Molecular Weight:

222.24

Description

P-PHENYLENEDIPROPIONIC ACID is an extensively employed biomedicine chemical compound that showcases its proficiency in the curative approach against oxidative stress-related ailments. Functioning as a remarkable antioxidant, it shields cellular structures against the injurious impacts induced by free radicals. This acid serves as a viable therapeutic option for a wide array of ailments comprising neurodegenerative disorders, atherosclerosis, and age-related macular degeneration.

Synonyms

1,4-PHENYLENEDIPROPIONIC ACID; P-PHENYLENEDIPROPIONIC ACID; 3,3'-(p-phenylene)dipropionic acid; p-Benzenedipropionic acid.; p-Phenylenedipropionic acid, HPLC 98%; 1,4-Benzenedipropionic acid; 3,3'-(1,4-Phenylene)bis(propionic acid); 3,3'-(1,4-Phenylene)bispropa

IUPAC Name

3-[4-(2-carboxyethyl)phenyl]propanoic acid

Canonical SMILES

C1=CC(=CC=C1CCC(=O)O)CCC(=O)O

InChI

InChI=1S/C12H14O4/c13-11(14)7-5-9-1-2-10(4-3-9)6-8-12(15)16/h1-4H,5-8H2,(H,13,14)(H,15,16)

InChI Key

DFOCUWFSRVQSNI-UHFFFAOYSA-N

Melting Point

231-234 °C (lit.)

Flash Point

Not applicable

Purity

98%

Density

1.253g/cm3

Computed Properties

XLogP3

1.4

Hydrogen Bond Donor Count

Hydrogen Bond Acceptor Count

Rotatable Bond Count

Exact Mass

222.08920892 g/mol

Monoisotopic Mass

222.08920892 g/mol

Topological Polar Surface Area

74.6Å²

Heavy Atom Count

Formal Charge

Complexity

215

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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P-PHENYLENEDIPROPIONIC ACID

Product Information

Computed Properties

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