N-Ethyltoluenesulfonamide (o and p mixture)

Inquiry

Molecular Formula:

C9H13NO2S

Molecular Weight:

199.27

CAS Number:

76902-32-4

Catalog Number:

76902-32-4

Product Information

Molecular Formula:

C9H13NO2S

Molecular Weight:

199.27

Description

N-Ethyltoluenesulfonamide (o and p mixture) is a highly versatile biomedical compound with exceptional chemical properties. It holds great promise in the realm of drug development and research. Its multifaceted applications encompass pharmaceutical and agrochemical synthesis, offering a wealth of opportunities for scientific advancements. Serving as a critical component, it diligently contributes to the treatment of numerous diseases that afflict humanity, such as cancer, diabetes, and cardiovascular disorders.

Synonyms

N-Ethyl-2-methylbenzenesulfonamide mixture with N-Ethyl-4-methylbenzenesulfonamide

IUPAC Name

N-ethyl-2-methylbenzenesulfonamideN-ethyl-4-methylbenzenesulfonamide

Canonical SMILES

CCNS(=O)(=O)C1=CC=C(C=C1)C.CCNS(=O)(=O)C1=CC=CC=C1C

InChI

InChI=1S/2C9H13NO2S/c1-3-10-13(11,12)9-6-4-8(2)5-7-91-3-10-13(11,12)9-7-5-4-6-8(9)2/h2*4-7,10H,3H2,1-2H3

InChI Key

IDLSDSKPHLCUTN-UHFFFAOYSA-N

Flash Point

193 °C

Purity

>98.0%(N)

Density

1.21

Application

The compounds exhibit the ability to inhibit tumor growth, shrink (i.e., necrotize) tumors, and prevent tumor formation in humans.

Refractive Index

1.54

Computed Properties

Hydrogen Bond Donor Count

Hydrogen Bond Acceptor Count

Rotatable Bond Count

Exact Mass

398.13339966 g/mol

Monoisotopic Mass

398.13339966 g/mol

Topological Polar Surface Area

109Å²

Heavy Atom Count

Formal Charge

Complexity

478

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

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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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N-Ethyltoluenesulfonamide (o and p mixture)

Product Information

Computed Properties

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