N-Popylxanthic acid potassium salt

Inquiry

Molecular Formula:

C4H7KOS2

Molecular Weight:

174.33

CAS Number:

2720-67-4

Catalog Number:

2720-67-4

Product Information

Molecular Formula:

C4H7KOS2

Molecular Weight:

174.33

Description

N-Popylxanthic acid potassium salt is a biomedical compound that notably finds application in the therapeutic realm of rheumatoid arthritis. Its commendable immunosuppressive properties empower it to functionally impede the vigor of T cells. Through this precise mechanism, utmost efficacy is attained in mitigating inflammation and assuaging the multifarious symptomatic manifestations intricately concomitant with this perpetual autoimmune malady.

Synonyms

Potassium O-Propyl Dithiocarbonate

IUPAC Name

potassiumpropoxymethanedithioate

Canonical SMILES

CCCOC(=S)[S-].[K+]

InChI

InChI=1S/C4H8OS2.K/c1-2-3-5-4(6)7/h2-3H2,1H3,(H,6,7)/q+1/p-1

InChI Key

NZUFLKMNMAHESJ-UHFFFAOYSA-M

Purity

>90.0%(T)

Appearance

Light orange to Yellow to Green powder to crystal

Safety Information

Hazards

H302+H312+H332:
Harmful if swallowed.
Harmful in contact with skin.
Harmful if inhaled.
H315:
Causes skin irritation.
H319:
Causes serious eye irritation.

Precautionary Statement

P261:
Avoid breathing dust, fumes, gas, mist, vapours, spray. [As modified by IV ATP].
P264:
Wash thoroughly after handling.
P280:
Wear protective gloves/protective clothing/eye protection/face protection.
P302+P352+P312:
IF ON SKIN:
Wash with plenty of soap and water.
Call a POISON CENTER or doctor/physician if you feel unwell.
P304+P340+P312:
IF INHALED:
Remove person to fresh air and keep comfortable for breathing.
Call a POISON CENTER or doctor/physician if you feel unwell.
P337+P313:
If eye irritation persists:
Get medical advice/attention.

Computed Properties

Hydrogen Bond Donor Count

Hydrogen Bond Acceptor Count

Rotatable Bond Count

Exact Mass

173.95753867 g/mol

Monoisotopic Mass

173.95753867 g/mol

Topological Polar Surface Area

42.3Å²

Heavy Atom Count

Formal Charge

Complexity

67.1

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

Patents

Publication Number	Title	Priority Date
WO-2022024672-A1	Film molded body	2020-07-29
JP-2021169182-A	Tire manufacturing method and tire	2020-04-15
WO-2021171994-A1	Method for producing dip-molded article	2020-02-27
WO-2021171993-A1	Latex composition	2020-02-26
WO-2021166724-A1	Method for producing latex composition	2020-02-20
WO-2021166725-A1	Latex composition production method	2020-02-20
WO-2021132075-A1	Xanthogen compound dispersion, conjugated diene-based polymer latex composition, film molded body, dip molded body and adhesive composition	2019-12-27
JP-2020002379-A	Rubber composition and tire	2019-10-01
JP-6778307-B2	Rubber composition and tires	2019-10-01
WO-2021054242-A1	Latex composition, film-formed article, and dip-molded article	2019-09-20

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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