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22767-50-6

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22767-50-6 Usage

Description

Sodium 1-heptanesulfonate is a member of the sodium alkylsulfonate group of surfactants, characterized by a -SO? head group with sodium and an alkyl chain attached to the head group. It is a white crystalline powder with a critical micelle concentration value of 0.302 mol/dm3.

Uses

Used in Detergent and Emulsifier Industry:
Sodium 1-heptanesulfonate is used as a reactant for the preparation of surfactants, which are essential components in the formulation of detergents and emulsifiers. Its surfactant properties contribute to the effectiveness of these products in cleaning and stabilizing mixtures of oil and water.
Used in Pharmaceutical Industry:
Sodium 1-heptanesulfonate may be utilized in cancer therapy through its interaction with NRF2-ARE, a potential therapeutic target for cancer treatment. This application highlights its potential as a compound with pharmaceutical relevance.
Used in Analytical Chemistry:
Sodium 1-heptanesulfonate is used as an ion-pairing reagent for high-performance liquid chromatography (HPLC), including the analysis of peptides and proteins. The anionic sulfonate counterion allows for the separation and resolution of positively charged analytes, making it a valuable tool in the analysis of both organic and inorganic small molecule compounds. It is also commonly incorporated in HPLC analysis of pharmaceutical products or metabolites.
Additionally, Sodium 1-heptanesulfonate is utilized in high-performance capillary electrophoresis analysis of peptides, further demonstrating its versatility in analytical chemistry applications.

Biochem/physiol Actions

Sodium 1-heptanesulfonate serves as an ion-pairing reagent for analysis of epinephrine and norepinephrine in ion-pairing chromatography (IPC).

Check Digit Verification of cas no

The CAS Registry Mumber 22767-50-6 includes 8 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 5 digits, 2,2,7,6 and 7 respectively; the second part has 2 digits, 5 and 0 respectively.
Calculate Digit Verification of CAS Registry Number 22767-50:
(7*2)+(6*2)+(5*7)+(4*6)+(3*7)+(2*5)+(1*0)=116
116 % 10 = 6
So 22767-50-6 is a valid CAS Registry Number.
InChI:InChI=1/C7H16O3S.Na/c1-2-3-4-5-6-7-11(8,9)10;/h2-7H2,1H3,(H,8,9,10);

22767-50-6 Well-known Company Product Price

  • Brand
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  • Detail
  • Alfa Aesar

  • (A10917)  Sodium 1-heptanesulfonate, 99% (dry wt.), water <2%   

  • 22767-50-6

  • 5g

  • 263.0CNY

  • Detail
  • Alfa Aesar

  • (A10917)  Sodium 1-heptanesulfonate, 99% (dry wt.), water <2%   

  • 22767-50-6

  • 25g

  • 873.0CNY

  • Detail
  • Alfa Aesar

  • (A10917)  Sodium 1-heptanesulfonate, 99% (dry wt.), water <2%   

  • 22767-50-6

  • 100g

  • 2879.0CNY

  • Detail
  • Sigma-Aldrich

  • (51834)  Sodium1-heptanesulfonatesolution  for ion pair chromatography, concentrate, ampule

  • 22767-50-6

  • 51834-6X1AMP-F

  • 4,320.81CNY

  • Detail

22767-50-6SDS

SAFETY DATA SHEETS

According to Globally Harmonized System of Classification and Labelling of Chemicals (GHS) - Sixth revised edition

Version: 1.0

Creation Date: Aug 11, 2017

Revision Date: Aug 11, 2017

1.Identification

1.1 GHS Product identifier

Product name sodium,heptane-1-sulfonate

1.2 Other means of identification

Product number -
Other names 1-heptanesulfonic acid,sodium salt

1.3 Recommended use of the chemical and restrictions on use

Identified uses For industry use only.
Uses advised against no data available

1.4 Supplier's details

1.5 Emergency phone number

Emergency phone number -
Service hours Monday to Friday, 9am-5pm (Standard time zone: UTC/GMT +8 hours).

More Details:22767-50-6 SDS

22767-50-6Synthetic route

1-Chloroheptane
629-06-1

1-Chloroheptane

sodium heptanesulfonate
22767-50-6

sodium heptanesulfonate

Conditions
ConditionsYield
With water; sodium sulfite at 200℃;
1-Bromoheptane
629-04-9

1-Bromoheptane

sodium heptanesulfonate
22767-50-6

sodium heptanesulfonate

Conditions
ConditionsYield
With sodium sulfite In water for 24h; Heating;
n-heptane
142-82-5

n-heptane

sodium heptanesulfonate
22767-50-6

sodium heptanesulfonate

Conditions
ConditionsYield
Stage #1: n-heptane With P25; sulfur dioxide; oxygen for 5h; Irradiation;
Stage #2: With sodium hydroxide In methanol Mechanism; Reagent/catalyst; Solvent; chemoselective reaction;
600 mg
choline chloride
67-48-1

choline chloride

sodium heptanesulfonate
22767-50-6

sodium heptanesulfonate

choline heptanesulfonate

choline heptanesulfonate

Conditions
ConditionsYield
In chloroform at 20℃; for 5h;95%
sodium heptanesulfonate
22767-50-6

sodium heptanesulfonate

heptanesulfonyl chloride
927-92-4

heptanesulfonyl chloride

Conditions
ConditionsYield
With thionyl chloride In benzene for 4h; Heating;
With phosphorus pentachloride at 140℃; for 0.75h; Neat (no solvent);
With oxalyl dichloride; N,N-dimethyl-formamide In dichloromethane at 20℃; for 1h;
With thionyl chloride Reflux; Inert atmosphere;
With thionyl chloride for 6h; Reflux; Inert atmosphere;
sodium heptanesulfonate
22767-50-6

sodium heptanesulfonate

heptane-1-sulfonic acid (2-oxo-tetrahydro-furan-3-yl)-amide
797059-78-0

heptane-1-sulfonic acid (2-oxo-tetrahydro-furan-3-yl)-amide

Conditions
ConditionsYield
Multi-step reaction with 2 steps
1: thionyl chloride / benzene / 4 h / Heating
2: 1,8-diazabicyclo[5.4.0]-undec-7-ene; 4-dimethylaminopyridine / CH2Cl2 / 24 h / 20 °C
View Scheme
bis(ethylenediamine)palladium(II) dibromide

bis(ethylenediamine)palladium(II) dibromide

bromine
7726-95-6

bromine

sodium heptanesulfonate
22767-50-6

sodium heptanesulfonate

[Pd(ethylenediamine)2][PdBr2(ethylenediamine)](heptylsulfonate)4*2H2O

[Pd(ethylenediamine)2][PdBr2(ethylenediamine)](heptylsulfonate)4*2H2O

Conditions
ConditionsYield
In water Br2 gas diffused to aq. soln. contg. C7H15SO3Na and Pd complex;
sodium heptanesulfonate
22767-50-6

sodium heptanesulfonate

N-(3-(5-(3'-O-Acetyl-2'-deoxyuridine))prop-2-ynyl)heptane-1-sulfonamide
1311414-38-6

N-(3-(5-(3'-O-Acetyl-2'-deoxyuridine))prop-2-ynyl)heptane-1-sulfonamide

Conditions
ConditionsYield
Multi-step reaction with 3 steps
1: thionyl chloride / Reflux; Inert atmosphere
2: triethylamine / dichloromethane / 0 - 20 °C / Inert atmosphere
3: copper(l) iodide; tetrakis(triphenylphosphine) palladium(0); N-ethyl-N,N-diisopropylamine / N,N-dimethyl-formamide / 20 °C / Inert atmosphere
View Scheme
sodium heptanesulfonate
22767-50-6

sodium heptanesulfonate

N-(3-(5-(2'-deoxyuridine-5'-monophosphate))prop-2-ynyl)heptane-1-sulfonamide disodium salt

N-(3-(5-(2'-deoxyuridine-5'-monophosphate))prop-2-ynyl)heptane-1-sulfonamide disodium salt

Conditions
ConditionsYield
Multi-step reaction with 5 steps
1.1: thionyl chloride / Reflux; Inert atmosphere
2.1: triethylamine / dichloromethane / 0 - 20 °C / Inert atmosphere
3.1: copper(l) iodide; tetrakis(triphenylphosphine) palladium(0); N-ethyl-N,N-diisopropylamine / N,N-dimethyl-formamide / 20 °C / Inert atmosphere
4.1: pyridine; pyridinium β-cyanoethyl phosphate; dicyclohexyl-carbodiimide / 48 h / 20 °C / Inert atmosphere
5.1: water; sodium hydroxide / 0.08 h / 100 °C
5.2: Dowex 50-WX8 (Na+ form)
View Scheme
sodium heptanesulfonate
22767-50-6

sodium heptanesulfonate

C21H32N3O11PS

C21H32N3O11PS

Conditions
ConditionsYield
Multi-step reaction with 4 steps
1: thionyl chloride / Reflux; Inert atmosphere
2: triethylamine / dichloromethane / 0 - 20 °C / Inert atmosphere
3: copper(l) iodide; tetrakis(triphenylphosphine) palladium(0); N-ethyl-N,N-diisopropylamine / N,N-dimethyl-formamide / 20 °C / Inert atmosphere
4: pyridine; pyridinium β-cyanoethyl phosphate; dicyclohexyl-carbodiimide / 48 h / 20 °C / Inert atmosphere
View Scheme
sodium heptanesulfonate
22767-50-6

sodium heptanesulfonate

benzoyl isocyanate
4461-33-0

benzoyl isocyanate

benzoylcarbamic heptane-1-sulfonic anhydride

benzoylcarbamic heptane-1-sulfonic anhydride

Conditions
ConditionsYield
In toluene Schlenk technique; Inert atmosphere; Reflux;293 mg

22767-50-6Downstream Products

22767-50-6Relevant articles and documents

Visible-light-induced sulfoxidation of alkanes in the presence of titania

Parrino, Francesco,Ramakrishnan, Ayyappan,Damm, Cornelia,Kisch, Horst

, p. 713 - 720 (2013/01/14)

The first catalytic photosulfoxidation of alkanes is accomplished in the presence of titanium dioxide and visible light (λ≥400 nm) under an atmosphere of SO2/O2. For n-heptane and cyclohexane the reaction is performed in the neat liquid, for adamantane in glacial acetic acid. Charge-transfer (CT) complexation of sulfur dioxide by the titania surface generates a CT band at 400-420 nm responsible for the visible-light activity of otherwise only UV light absorbing titania. The primary charges generated upon optical electron transfer produce alkyl radicals by dissociative electron transfer from the alkane and by hydrogen abstraction by OH radicals produced from oxygen reduction. Once formed, the alkyl radicals initiate a radical chain reaction as known from the classical UV-induced sulfoxidation in the absence of a catalyst. The reaction exhibits features characteristic for product inhibition by strong adsorption. Accordingly, the initial photocatalytic activity is fully restored after washing the catalyst with methanol. Time-resolved photovoltage measurements indicate that photocatalyst deactivation is connected with a change from n-type to p-type titanium dioxide. Small amounts of water and radical scavengers inhibit product formation. The reaction proceeds with high chemoselectivity because only traces of expected by-products like sulfates, ketones, and alcohols are formed. Thus, in addition to its basic role in visible-light-induced charge generation, the surface of titania enables also a chemoselective C-S bond formation.

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