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58032-84-1

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58032-84-1 Structure

58032-84-1 Structure
IdentificationBack Directory
[Name]

3-NITROPHENYLMETHANESULFONYL CHLORIDE
[CAS]

58032-84-1
[Synonyms]

3-Nitrobenzylsulfonyl Chloride
3-nitro-à-toluenesulfonyl chlorid
3-nitro-ɑ-toluenesulfonyl chlorid
3-Nitro-α-toluenesulfonyl chloride
3-nitro-à-toluenesulfonyl chloride
3-NITROPHENYLMETHANESULFONYL CHLORIDE
3-NITRO-ALPHA-TOLUENESULFONYL CHLORIDE
3-NitroBenzenemethanesulfonyl chloride
3-Nitro-ɑ-toluenesulfonyl chloride, 95%
3-Nitro-^a-toluenesulfonyl chloride, 95%
Benzenemethanesulfonyl chloride, 3-nitro-
[Molecular Formula]

C7H6ClNO4S
[MDL Number]

MFCD01859935
[MOL File]

58032-84-1.mol
[Molecular Weight]

235.64
Chemical PropertiesBack Directory
[Melting point ]

95-100°C
[Boiling point ]

393.2±25.0 °C(Predicted)
[density ]

1.570±0.06 g/cm3(Predicted)
[storage temp. ]

Inert atmosphere,2-8°C
[Appearance]

Off-white to light brown Solid
[Water Solubility ]

Reacts with water.
[Sensitive ]

Moisture Sensitive
[InChI]

InChI=1S/C7H6ClNO4S/c8-14(12,13)5-6-2-1-3-7(4-6)9(10)11/h1-4H,5H2
[InChIKey]

IUYFKLDRPZLAQQ-UHFFFAOYSA-N
[SMILES]

C1(CS(Cl)(=O)=O)=CC=CC([N+]([O-])=O)=C1
Safety DataBack Directory
[Hazard Codes ]

Xn
[Risk Statements ]

20/21-34-65-22
[Safety Statements ]

26-27-36/37/39
[RIDADR ]

3261
[HazardClass ]

8
[PackingGroup ]

II
[HS Code ]

2904990090
Raw materials And Preparation ProductsBack Directory
[Raw materials]

Hydrochloric acid-->Methanol-->Diethyl ether-->Acetic acid-->Thionyl chloride-->Phosphorus oxitrichloride-->Magnesium sulfate-->Sodium sulfite-->Phosphorus pentachloride-->Sodium bisulfite-->Manganese dioxide-->Sodium thiosulfate-->Methyl trioctyl ammonium chloride-->4-Nitrobenzyl alcohol
Hazard InformationBack Directory
[Uses]

3-Nitrobenzenemethanesulfonyl chloride is used as a reactant or reagent for organic reactions and synthesis.
[Synthesis]

Preparation of (3-nitrophenyl)methanethiol: a solution of O-ethyl S-3-nitrobenzyl dithiocarbonate (11.55 g, 44.9 mmol) in DMSO (20 mL) was added to a DMSO (20 mL) solution of ethylenediamine (4.8 mL, 1.6 eq.) and concentrated HCl (1.8 mL, 0.5 eq.), whi

Spectrum DetailBack Directory
[Spectrum Detail]

3-NITROPHENYLMETHANESULFONYL CHLORIDE(58032-84-1)1HNMR
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