ChemicalBook--->CAS DataBase List--->6961-82-6

6961-82-6

6961-82-6 Structure

6961-82-6 Structure
IdentificationMore
[Name]

o-Chlorobenzenesulfonamide
[CAS]

6961-82-6
[Synonyms]

2-CHLOROBENZENESULFONAMIDE
2-CHLOROBENZENESULPHONAMIDE
BUTTPARK 37\11-77
o-chlorobenzenesulfonamide
2-chloro-benzenedulfonamid
Benzenesulfonamide, 2-chloro-
Benzenesulfonamide, o-chloro-
o-chlorobenzenesulphonamide
Benzenesulfonamide, 2-chloro-(9CI)
P-CHLOROBENZENE SUFONAMIDE
2-CHLOROBEZENESULFONAMIDE
[EINECS(EC#)]

230-156-7
[Molecular Formula]

C6H6ClNO2S
[MDL Number]

MFCD00051974
[Molecular Weight]

191.64
[MOL File]

6961-82-6.mol
Chemical PropertiesBack Directory
[Melting point ]

189-193 °C(lit.)
[Boiling point ]

352.9±44.0 °C(Predicted)
[density ]

1.408 (estimate)
[refractive index ]

1.6000 (estimate)
[storage temp. ]

Refrigerator
[solubility ]

DMSO (Slightly), Methanol (Slightly)
[form ]

Solid
[pka]

9.66±0.60(Predicted)
[color ]

Off-White
[Water Solubility ]

498.3mg/L(15 ºC)
[BRN ]

2937540
[InChI]

1S/C6H6ClNO2S/c7-5-3-1-2-4-6(5)11(8,9)10/h1-4H,(H2,8,9,10)
[InChIKey]

JCCBZCMSYUSCFM-UHFFFAOYSA-N
[SMILES]

NS(=O)(=O)c1ccccc1Cl
[CAS DataBase Reference]

6961-82-6(CAS DataBase Reference)
[NIST Chemistry Reference]

2-Chlorobenzenesulfonamide(6961-82-6)
[EPA Substance Registry System]

6961-82-6(EPA Substance)
Safety DataBack Directory
[Hazard Codes ]

Xi
[Risk Statements ]

R36/37/38:Irritating to eyes, respiratory system and skin .
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36:Wear suitable protective clothing .
[WGK Germany ]

3
[Hazard Note ]

Irritant
[TSCA ]

Yes
[HazardClass ]

IRRITANT
[HS Code ]

29350090
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Eye Irrit. 2
Skin Irrit. 2
STOT SE 3
Raw materials And Preparation ProductsBack Directory
[Raw materials]

Copper(II) sulfate-->Sulfur dioxide-->Sodium metabisulfite-->Dichloroethane-->2-Chloroaniline-->Chloramine-T-->Potassium iodide statch paper-->2-Chlorobenzenesulfonyl chloride-->Benzenediazonium, 2-chloro-, tetrafluoroborate(1-)-->N-Methylbenzenesulfonamide-->Ammonium hydroxide
[Preparation Products]

Chlorsulfuron-->O-(2-MethoxyEthoxy)BenzeneSulfonamide-->Cinosulfuron-->2-Chlorobenzenesulfonyl isocyanate-->Carbon dioxide
Hazard InformationBack Directory
[Uses]

2-Chlorobenzenesulfonamide may be used in the synthesis of 2-chloro-N-(4-methoxybenzoyl)benzenesulfonamide and 1,2,4-thiadiazine ,1-dioxides.
[General Description]

2-Chlorobenzenesulfonamide is a halogenated sulfonamide derivative. It is formed as one of the major degradation product of chlorosulfuron. Crystals of 2-chlorobenzenesulfonamide exhibit monoclinic space group Cc. Its molecules are linked by N1—H11···O1 and N1—H12···O2 hydrogen bonding to form an infinite 3-D molecular network.
Spectrum DetailBack Directory
[Spectrum Detail]

o-Chlorobenzenesulfonamide(6961-82-6)MS
o-Chlorobenzenesulfonamide(6961-82-6)1HNMR
o-Chlorobenzenesulfonamide(6961-82-6)IR1
o-Chlorobenzenesulfonamide(6961-82-6)IR2
Well-known Reagent Company Product InformationBack Directory
[Alfa Aesar]

2-Chlorobenzenesulfonamide, 98%(6961-82-6)
[Sigma Aldrich]

6961-82-6(sigmaaldrich)
[TCI AMERICA]

2-Chlorobenzenesulfonamide,>98.0%(T)(6961-82-6)
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