ChemicalBook--->CAS DataBase List--->5324-84-5

5324-84-5

5324-84-5 Structure

5324-84-5 Structure
IdentificationMore
[Name]

Sodium 1-octanesulfonate
[CAS]

5324-84-5
[Synonyms]

1-OCTANESULFONATE, SODIUM
1-OCTANESULFONATE, SODIUM SALT
1-OCTANE SULFONIC ACID, NA
1-OCTANESULFONIC ACID NA-SALT
1-OCTANESULFONIC ACID SODIUM SALT
1-OCTANESULPHONATE, SODIUM SALT
1-OCTANESULPHONIC ACID SODIUM SALT
IPC-ALKS-8
IPC(TM) B8
N-OCTYLSULFONIC ACID SODIUM SALT
OCTANE-1-SULFONIC ACID SODIUM SALT
OCTANE SULFONIC ACID SODIUM SALT
OCTYL SODIUM SULFONATE
SODIUM 1-OCTANESULFONATE
SODIUM 1-OCTANESULPHONATE
SODIUM OCTANESULFONATE
SODIUM OCTYL SULFONATE
1-0ctanesulfonicacid,sodiumsalt
1-0ctanesulfonicacidsodiumsalt,monohydrate
1-octanesulfonicacid,sodiumsalthydrate
[EINECS(EC#)]

226-195-4
[Molecular Formula]

C8H17NaO3S
[MDL Number]

MFCD00007544
[Molecular Weight]

216.27
[MOL File]

5324-84-5.mol
Chemical PropertiesBack Directory
[Appearance]

white powder
[Melting point ]

>300 °C(lit.)
[Boiling point ]

>300 °C(lit.)
[bulk density]

345kg/m3
[storage temp. ]

Store at +5°C to +30°C.
[solubility ]

H2O: soluble1M at 20°C, clear, colorless
[form ]

Crystalline Powder
[color ]

White
[PH]

5.5-7.5 (100g/l, H2O, 20℃)
[PH Range]

5.5 - 7.5
[Stability:]

Stable. Incompatible with strong oxidizing agents.
[biological source]

synthetic (oragnic)
[Water Solubility ]

Soluble in water producing a clear and colorless solution.
[λmax]

λ: 210 nm Amax: 0.08
λ: 220 nm Amax: 0.05
λ: 230 nm Amax: 0.03
λ: 260 nm Amax: 0.02
λ: 500 nm Amax: 0.02
[Detection Methods]

T,UV
[BRN ]

3574241
[Cosmetics Ingredients Functions]

CLEANSING
SURFACTANT - CLEANSING
SURFACTANT - EMULSIFYING
[InChI]

1S/C8H18O3S.Na/c1-2-3-4-5-6-7-8-12(9,10)11;/h2-8H2,1H3,(H,9,10,11);/q;+1/p-1
[InChIKey]

HRQDCDQDOPSGBR-UHFFFAOYSA-M
[SMILES]

[Na+].CCCCCCCCS([O-])(=O)=O
[LogP]

-2.25 at 19.8℃
[CAS DataBase Reference]

5324-84-5(CAS DataBase Reference)
[EPA Substance Registry System]

5324-84-5(EPA Substance)
Safety DataBack Directory
[Symbol(GHS) ]

Corrosion (GHS05)
GHS05
[Signal word ]

Danger
[Hazard statements ]

H314
[Precautionary statements ]

P260-P280-P301+P330+P331-P303+P361+P353-P304+P340+P310-P305+P351+P338
[Hazard Codes ]

Xi,C,F
[Risk Statements ]

R36/37/38:Irritating to eyes, respiratory system and skin .
R34:Causes burns.
R11:Highly Flammable.
[Safety Statements ]

S22:Do not breathe dust .
S24/25:Avoid contact with skin and eyes .
S45:In case of accident or if you feel unwell, seek medical advice immediately (show label where possible) .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S16:Keep away from sources of ignition-No smoking .
[WGK Germany ]

3
[TSCA ]

Yes
[REACH Registrations]

Active
[HS Code ]

29041000
[Storage Class]

8B - Non-combustible corrosive hazardous materials
[Hazard Classifications]

Eye Dam. 1
Skin Corr. 1B
Raw materials And Preparation ProductsBack Directory
[Raw materials]

Ethanol-->Ethyl acetate-->Sodium sulfite-->1-Bromooctane-->1-Octanesulfonic acid, sodium salt, monohydrate
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

1-Octanesulfonic acid sodium salt(5324-84-5).msds
Questions And AnswerBack Directory
[Description]

Sodium 1-octanesulfonate can be used as ion-pairing reagent for ultra-high performance liquid chromatography (UPLC) analysis with photodiode array detection, to estimate paraquat (methyl viologen) in tissue homogenate1,2. It may also be used in determination of dopamine and its metabolites in brain microdialysates using liquid chromatography combined with electrospray ionization tandem mass spectrometry (LC–ESI-MS/MS). It can also be used as a reagent for HPLC analysis of organic compounds, and more specifically, peptides and proteins. It is found to interact with human serum albumin. It is also used as an ion complexation agent for N-nitrosodiethanolamine3. Its monohydrate is used as an anionic detergent and is a surface-active reagent4.
[Sources]

  1. https://www.sigmaaldrich.com/catalog/product/sial/74884?lang=en&region=US
  2. Orentien?, Asta, et al. "UPLC a Powerful Tool for the Separation of Imidazolium Ionic Liquid Cations." Chromatographia 73.1-2(2011): 17-24.
  3. https://www.alfa.com/en/catalog/A14292/
  4. https://www.alfa.com/en/catalog/015764/
Hazard InformationBack Directory
[Chemical Properties]

white powder
[Uses]

suzuki reaction
[General Description]

Concentrate for 6x1 L ready-to-use solution. Dilute contents of one ampule (~0.3 M) to 1 L with HPLC grade water to obtain a 0.005 M eluent solution.
[Flammability and Explosibility]

Notclassified
[Biological Activity]

1-Octanesulfonic acid sodium salt is hydrophilic in nature and has the ability to allow the ion exchange phenomenon due to the presence of sodium ions. For the formation of GOBCit intercalates GO to form a nanoporous graphene th at has a high adsorption capacity
[Purification Methods]

Recrystallise it from absolute EtOH. [Beilstein 4 IV 58.]
Spectrum DetailBack Directory
[Spectrum Detail]

Sodium 1-octanesulfonate(5324-84-5)1HNMR
Sodium 1-octanesulfonate(5324-84-5)13CNMR
Sodium 1-octanesulfonate(5324-84-5)IR1
Sodium 1-octanesulfonate(5324-84-5)IR2
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

1-Octanesulfonic acid, sodium salt, HPLC grade(5324-84-5)
[Alfa Aesar]

Sodium 1-octanesulfonate, 99%(5324-84-5)
[Sigma Aldrich]

5324-84-5(sigmaaldrich)
[TCI AMERICA]

Sodium 1-Octanesulfonate,>98.0%(T)(5324-84-5)
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