ChemicalBook--->CAS DataBase List--->85-46-1

85-46-1

85-46-1 Structure

85-46-1 Structure
IdentificationMore
[Name]

1-Naphthalenesulfonyl chloride
[CAS]

85-46-1
[Synonyms]

1-NAPHTHALENESULFONYL CHLORIDE
1-NAPHTHALENESULPHONYL CHLORIDE
NAPHTHALENE-1-SULFONYL CHLORIDE
NAPHTHALENE-1-SULPHONYL CHLORIDE
NAPHTHOSULFOCHLORIDE
.alpha.-Napthalenesulfonylchloride
1-Naphthylsulfonyl chloride
alpha-Naphthalenesulfochloride
alpha-Naphthalenesulfonyl chloride
Naphthalene sulfonyl chloride
1-NAPTHALENESULFONIC CHLORIDE
1-Chlorosulfonylnaphthalene
1-Naphthalenesulfonic acid chloride
Naphthalene-1-sulfonic acid chloride
[EINECS(EC#)]

201-609-6
[Molecular Formula]

C10H7ClO2S
[MDL Number]

MFCD00003984
[Molecular Weight]

226.68
[MOL File]

85-46-1.mol
Chemical PropertiesBack Directory
[Appearance]

white to beige crystalline powder
[Melting point ]

64-67 °C (lit.)
[Boiling point ]

194-195 °C/13 mmHg (lit.)
[density ]

1.3661 (estimate)
[Fp ]

194-195°C/13mm
[storage temp. ]

Inert atmosphere,Room Temperature
[solubility ]

chloroform: soluble25mg/mL, clear to very slightly hazy, colorless to yellow
[Water Solubility ]

insoluble
[Sensitive ]

Moisture Sensitive
[BRN ]

2099333
[CAS DataBase Reference]

85-46-1(CAS DataBase Reference)
[NIST Chemistry Reference]

1-Naphthalenesulfonyl chlorine(85-46-1)
[EPA Substance Registry System]

85-46-1(EPA Substance)
Safety DataBack Directory
[Hazard Codes ]

C
[Risk Statements ]

R34:Causes burns.
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
S45:In case of accident or if you feel unwell, seek medical advice immediately (show label where possible) .
S27:Take off immediately all contaminated clothing .
[RIDADR ]

UN 3261 8/PG 2
[WGK Germany ]

3
[F ]

10-21
[Hazard Note ]

Corrosive
[TSCA ]

Yes
[HazardClass ]

8
[PackingGroup ]

II
[HS Code ]

29049090
Raw materials And Preparation ProductsBack Directory
[Raw materials]

Phosphorus oxychloride-->Acetonitrile-->N,N-Dimethylacetamide-->Sulfolane-->Sodium 1-naphthalenesulfonate
[Preparation Products]

N-(1-NAPHTHALENESULFONYL)-L-PHENYLALANINE-->1-[(CHLOROMETHYL)SULFONYL]NAPHTHALENE-->1-Naphthalenesulfonyl fluoride-->5,8-dioxo-6-(pyridin-3-ylamino)naphthalene-1-sulfonamide-->N-(5-AMINOPENTYL)-1-NAPHTHALENESULFONAMIDE HCL-->SODIUMNAPHTHIONATE
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

1-Naphthalenesulfonyl chloride(85-46-1).msds
Hazard InformationBack Directory
[Chemical Properties]

white to beige crystalline powder
[Uses]

1-Naphthalenesulfonyl chloride has been used in the preparation of 5?-O-naphthaleneiulfonyldeoxyuridine and 1-sulfonylindazole derivatives. The derivatives of this compound is used for quantitative metabolome analysis New set of isotope reagents, 12C4-, 12C213C2-, and 13C4-5-diethylamino-naphthalene-1-sulfonyl chloride (DensCl), in combination with liquid chromatography Fourier-transform ion cyclotron resonance mass spectrometry (LC-FTICR-MS) is used for improved analysis of the amine- and phenol-containing submetabolome.
[General Description]

1-Naphthalenesulfonyl chloride undergoes desulfitative carbonylative Stille cross-coupling reaction with tinglucal derivative.
[Purification Methods]

If the IR indicates the presence of OH, then treat it with an equal weight of PCl5 and heat it at ca 100o for 2hours, cool and pour onto ice + H2O, stir well and filter off the solid. Wash the solid with cold H2O and dry the solid in a vacuum desiccator over P2O5 + solid KOH. Extract the solid with pet ether (b 40-60o), filter off any insoluble solid and cool. Collect the crystalline sulfonyl chloride and recrystallise it from dry Et2O, pet ether or *C6H6/pet ether. If large quantities are available, then it can be distilled under high vacuum. [Fierz-Davaid & Weissenbach Helv Chim Acta 3 2312 1920.] The sulfonamide crystallises from EtOH (m 150.5o) or H2O (m 153o). [Beilstein 11 H 175, 11 II 93, 11 IV 383.]
Spectrum DetailBack Directory
[Spectrum Detail]

1-Naphthalenesulfonyl chloride(85-46-1)MS
1-Naphthalenesulfonyl chloride(85-46-1)1HNMR
1-Naphthalenesulfonyl chloride(85-46-1)IR1
1-Naphthalenesulfonyl chloride(85-46-1)Raman
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

1-Naphthalenesulfonyl chloride, 99%(85-46-1)
[Alfa Aesar]

Naphthalene-1-sulfonyl chloride, 98%(85-46-1)
[Sigma Aldrich]

85-46-1(sigmaaldrich)
[TCI AMERICA]

1-Naphthalenesulfonyl Chloride,>98.0%(T)(85-46-1)
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