ChemicalBook--->CAS DataBase List--->1694-92-4

1694-92-4

1694-92-4 Structure

1694-92-4 Structure
IdentificationMore
[Name]

2-Nitrobenzenesulfonyl chloride
[CAS]

1694-92-4
[Synonyms]

2-NITROBENZENESULFONYL CHLORIDE
2-NITROBENZENESULPHONYL CHLORIDE
O-NITROBENZENESULFONYL CHLORIDE
2-Nitrobenaenesulfonylchloride
2-nitro-benzenesulfonylchlorid
Benzenesulfonylchloride,2-nitro-
1-(Chlorosulfonyl)-2-nitrobenzene
2-Nitro-benzenesulfonyl
2-Nitrobenzenesulphonyl chloride 97%
2-Nitrophenylsulfonyl chloride
2-NITROBENZENESULFONYL CHLORIDE 95+%
O-NITROBENZENE SUFONYL CHLORIDE
o-Nitrophenylsulfonyl chloride
2-Nitrobenzenesulfonic acid chloride
6-Nitrobenzenesulfonic acid chloride
[EINECS(EC#)]

216-907-1
[Molecular Formula]

C6H4ClNO4S
[MDL Number]

MFCD00007430
[Molecular Weight]

221.62
[MOL File]

1694-92-4.mol
Chemical PropertiesBack Directory
[Appearance]

Off-white tot yellow crystalline powder
[Melting point ]

63-67 °C(lit.)
[Boiling point ]

350.6±25.0 °C(Predicted)
[density ]

1.606±0.06 g/cm3(Predicted)
[storage temp. ]

Store below +30°C.
[form ]

powder to crystal
[color ]

White to Yellow to Orange
[Water Solubility ]

Soluble in toluene, tetrahydrofuran, methylene chloride, ethyl acetate and dimethylformamide. Insoluble in water.
[Sensitive ]

Moisture Sensitive
[BRN ]

521155
[InChI]

InChI=1S/C6H4ClNO4S/c7-13(11,12)6-4-2-1-3-5(6)8(9)10/h1-4H
[InChIKey]

WPHUUIODWRNJLO-UHFFFAOYSA-N
[SMILES]

C1(S(Cl)(=O)=O)=CC=CC=C1[N+]([O-])=O
[CAS DataBase Reference]

1694-92-4(CAS DataBase Reference)
[EPA Substance Registry System]

1694-92-4(EPA Substance)
Safety DataBack Directory
[Symbol(GHS) ]

Corrosion (GHS05)
GHS05
[Signal word ]

Danger
[Hazard statements ]

H314
[Precautionary statements ]

P260-P280-P303+P361+P353-P304+P340+P310-P305+P351+P338-P363
[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) .
[RIDADR ]

UN 3261 8/PG 2
[WGK Germany ]

3
[F ]

21
[Hazard Note ]

Corrosive/Moisture Sensitive
[TSCA ]

Yes
[REACH Registrations]

Inactive
[HazardClass ]

8
[PackingGroup ]

II
[HS Code ]

29049090
[Storage Class]

4.1A - Other explosive hazardous materials
[Hazard Classifications]

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

Nitric acid-->Bis(2-nitrophenyl) disulfide-->Benzenediazonium, 2-nitro-, chloride (1:1)-->2-Nitrothioanisole-->1-(Benzylsulfanyl)-2-nitrobenzene-->2-Nitrobenzenesulfenyl chloride-->2-nitrobenzenediazonium tetrafluoroborate
[Preparation Products]

1-[(2-Nitrophenyl)sulfonyl]-1H-pyrrole-2-carbaldehyde-->2-Nitrobenzenesulfonic acid-->2-Nitrothiophenol
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

2-Nitrobenzenesulfonyl chloride(1694-92-4).msds
Hazard InformationBack Directory
[Chemical Properties]

Off-white tot yellow crystalline powder
[Uses]

2-Nitrobenzenesulfonyl chloride acts as a reagent to form 2-nitrobenzenesulfonyl derivatives of alcohols and amines. It is also involved in the selective cleavage with thiophenol without displacement of the nitro group. Further, it is used in the preparation of renin inhibitors. In addition to this, it finds application as an anticonvulsant.
[Production Methods]

2-Nitrobenzenesulfonyl chloride is isolated as an intermediate in the production of 2-nitrobenzenesulfonic acid. When 2,2' - dinitrodiphenyl disulfide is chlorinated in an organic solvent the product is 2-nitrophenylsulfenyl chloride.
[Anticancer Research]

2-Nitrobenzenesulfonyl chloride has also been shown to inhibit cancer cells as well as human serum through hydrogen bond interactions.
Spectrum DetailBack Directory
[Spectrum Detail]

2-Nitrobenzenesulfonyl chloride(1694-92-4)MS
2-Nitrobenzenesulfonyl chloride(1694-92-4)1HNMR
2-Nitrobenzenesulfonyl chloride(1694-92-4)13CNMR
2-Nitrobenzenesulfonyl chloride(1694-92-4)IR1
2-Nitrobenzenesulfonyl chloride(1694-92-4)IR2
2-Nitrobenzenesulfonyl chloride(1694-92-4)IR3
2-Nitrobenzenesulfonyl chloride(1694-92-4)Raman
Well-known Reagent Company Product InformationBack Directory
[Alfa Aesar]

2-Nitrobenzenesulfonyl chloride, 97%(1694-92-4)
[Sigma Aldrich]

1694-92-4(sigmaaldrich)
[TCI AMERICA]

2-Nitrobenzenesulfonyl Chloride,>95.0%(T)(1694-92-4)
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