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4-chlorobenzenesulfonate

4-Chlorobenzenesulfonic acid

CAS: 98-66-8

Molecular Formula: C6H5ClO3S

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4-chlorobenzenesulfonate - Names and Identifiers

Name 4-Chlorobenzenesulfonic acid
Synonyms Closylate
4-chlorobenzenesulfonate
4-chloro-benzenesulfonicaci
P-CHLOROBENZENESULFONIC ACID
p-Chlorobenzenesulfonic acid
4-Chlorobenzenesulfonec acid
4-Chlorobenzenesulfonic acid
4-CHLOROBENZENESULFONIC ACID
4-Chlorobenzene Sulfonic Acid
4-CHLOROBENZENESULPHONIC ACID
4-Chloro Benzene Sulphonic Acid
4-CHLORO BENZENE SULPHONIC ACID
Benzenesulfonic acid, 4-chloro-
4-Chlorobenzensulfonic acid hydrate
CAS 98-66-8
EINECS 202-690-0
InChI InChI=1/C6H5ClO3S/c7-5-1-3-6(4-2-5)11(8,9)10/h1-4H,(H,8,9,10)/p-1
InChIKey RJWBTWIBUIGANW-UHFFFAOYSA-N

4-chlorobenzenesulfonate - Physico-chemical Properties

Molecular FormulaC6H5ClO3S
Molar Mass192.62
Density1.449 (estimate)
Melting Point102 °C
Boling Point149 °C/22 mmHg (lit.)
Water Solubilityvery faint turbidity
Vapor Presure0.00696mmHg at 25°C
Appearancesolid
ColorWhite to Light yellow to Light orange
Merck14,2122
pKa-0.83±0.50(Predicted)
Storage ConditionSealed in dry,Room Temperature
StabilityStable. Incompatible with strong oxidizing agents.
MDLMFCD00065342
Physical and Chemical PropertiesMelting Point: 102 ℃

4-chlorobenzenesulfonate - Risk and Safety

Hazard SymbolsC - Corrosive
Corrosive
Risk CodesR34 - Causes burns
R22 - Harmful if swallowed
Safety DescriptionS26 - In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
S27 - Take off immediately all contaminated clothing.
S28 - After contact with skin, wash immediately with plenty of soap-suds.
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 the label whenever possible.)
S24/25 - Avoid contact with skin and eyes.
UN IDsUN 2583 8/PG 2
WGK Germany3
RTECSDB5074000
HS Code29041000
Hazard Class8
Packing GroupIII

4-chlorobenzenesulfonate - Reference Information

NIST chemical information information provided by: webbook.nist.gov (external link)
EPA chemical substance information information provided by: ofmpeb.epa.gov (external link)
Use intermediate of medicine and dye.
production method (1) from the amino benzene sulfonic acid by diazotization, elimination of amino benzene sulfonic acid, hydrochloric acid added to water, after cooling to below 20 °c, sodium nitrite solution was added dropwise, and the diazo liquid was obtained at the end of the reaction. In addition, copper sulfate and sodium chloride were added to water at about 80 ° C., and after all of them were dissolved, an alkaline sodium sulfite solution was added dropwise. The reaction was completed for 20min, cooled to room temperature, allowed to stand, and the precipitate was washed by pouring method. Hydrochloric acid was added to dissolve, cooled to below 0 ° C., and the above diazo liquid was added dropwise to generate p-chlorobenzene sulfonic acid. The reaction solution was heated to 80 ° C., salted out with salt, and sodium p-chlorobenzene sulfonate was obtained by filtration. (2) 98% concentrated sulfuric acid and 10% fuming sulfuric acid were added to the reaction pan by sulfonation of chlorobenzene, and the mixture was stirred for 15min. Dry Chlorobenzene was gradually added, and the reaction was stirred at 95-100 ° C. For 5h to check the end point of sulfonation. When the end point is reached, the acidity of the reactant is not more than 70% and can be dissolved completely in water.
category toxic substances
toxicity grade poisoning
Acute toxicity oral-rat LD50: > 500 mg/kg
flammability hazard characteristics thermal decomposition of toxic sulfur oxides, chloride smoke
storage and transportation characteristics low temperature ventilation and drying
fire extinguishing agent water, carbon dioxide, foam, dry powder
Last Update:2024-04-09 02:00:12
4-chlorobenzenesulfonate
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View History
4-chlorobenzenesulfonate
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