2-PHENYL-2-(P-TOLUENESULFONYLOXY)ACETOPHENONE

Inquiry

Molecular Formula:

C21H18O4S

Molecular Weight:

366.43

CAS Number:

1678-43-9

Catalog Number:

1678-43-9

Product Information

Molecular Formula:

C21H18O4S

Molecular Weight:

366.43

Description

2-PHENYL-2-(P-TOLUENESULFONYLOXY)ACETOPHENONE is a pharmaceutical compound widely used in the biomedical industry. It exhibits potent anti-inflammatory and analgesic properties, making it a valuable tool for treating pain-related conditions such as arthritis and migraines. Additionally, this compound has shown promising results in inhibiting cancer cell growth, opening doors for potential anticancer therapies. Its precise mechanism of action and therapeutic potential make it an essential resource in biomedicine.

Synonyms

2-PHENYL-2-TOSYLOXYACETOPHENONE; 2-PHENYL-2-(P-TOLUENESULFONYLOXY)ACETOPHENONE; ALPHA-(P-TOLUENESULFONYLOXY)DEOXYBENZOIN; ALPHA-(TOSYLOXY)DEOXYBENZOIN; O-(P-TOLUENESULFONYL)BENZOIN; O-TOSYLBENZOIN; Benzoin 4-toluenesulfonate

IUPAC Name

(2-oxo-1,2-diphenylethyl) 4-methylbenzenesulfonate

Canonical SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC(C2=CC=CC=C2)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H18O4S/c1-16-12-14-19(15-13-16)26(23,24)25-21(18-10-6-3-7-11-18)20(22)17-8-4-2-5-9-17/h2-15,21H,1H3

InChI Key

DLDWUFCUUXXYTB-UHFFFAOYSA-N

Melting Point

109 °C

Purity

>97.0%(LC)

Appearance

White to Light yellow powder to crystal

Computed Properties

XLogP3

4.7

Hydrogen Bond Donor Count

Hydrogen Bond Acceptor Count

Rotatable Bond Count

Exact Mass

366.09258022 g/mol

Monoisotopic Mass

366.09258022 g/mol

Topological Polar Surface Area

68.8Å²

Heavy Atom Count

Formal Charge

Complexity

545

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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2-PHENYL-2-(P-TOLUENESULFONYLOXY)ACETOPHENONE

Product Information

Computed Properties

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