3-(Chlorosulfonyl)benzoyl chloride

Modify Date: 2024-01-05 21:52:32

3-(Chlorosulfonyl)benzoyl chloride Structure
3-(Chlorosulfonyl)benzoyl chloride structure
Common Name 3-(Chlorosulfonyl)benzoyl chloride
CAS Number 4052-92-0 Molecular Weight 239.076
Density 1.6±0.1 g/cm3 Boiling Point 344.0±25.0 °C at 760 mmHg
Molecular Formula C7H4Cl2O3S Melting Point 18-20ºC
MSDS N/A Flash Point 161.8±23.2 °C

 Names

Name 3-(Chlorosulfonyl)benzoyl chloride
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.6±0.1 g/cm3
Boiling Point 344.0±25.0 °C at 760 mmHg
Melting Point 18-20ºC
Molecular Formula C7H4Cl2O3S
Molecular Weight 239.076
Flash Point 161.8±23.2 °C
Exact Mass 237.925812
PSA 59.59000
LogP 2.38
Appearance of Characters Liquid After Melting | Clear yellow
Vapour Pressure 0.0±0.8 mmHg at 25°C
Index of Refraction 1.569

 MSDS

Name: 3-(Chlorosulfonyl)benzoyl Chloride 98% (Titr.) Material Safety Data Sheet
Synonym: None
CAS: 4052-92-0
Section 1 - Chemical Product MSDS Name:3-(Chlorosulfonyl)benzoyl Chloride 98% (Titr.) Material Safety Data Sheet
Synonym:None

Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS
CAS# Chemical Name content EINECS#
4052-92-0 3-(Chlorosulfonyl)benzoyl Chloride 98 223-759-1
Hazard Symbols: None Listed.
Risk Phrases: None Listed.

Section 3 - HAZARDS IDENTIFICATION
EMERGENCY OVERVIEW
The toxicological properties of this material have not been fully investigated.
Potential Health Effects
Eye:
May cause eye irritation.
Skin:
May cause skin irritation.
Ingestion:
May cause irritation of the digestive tract. The toxicological properties of this substance have not been fully investigated.
Inhalation:
May cause respiratory tract irritation. The toxicological properties of this substance have not been fully investigated.
Chronic:
No information found.

Section 4 - FIRST AID MEASURES
Eyes: Flush eyes with plenty of water for at least 15 minutes, occasionally lifting the upper and lower eyelids. Get medical aid immediately.
Skin:
Get medical aid. Flush skin with plenty of water for at least 15 minutes while removing contaminated clothing and shoes. Wash clothing before reuse.
Ingestion:
If victim is conscious and alert, give 2-4 cupfuls of milk or water.
Never give anything by mouth to an unconscious person. Get medical aid immediately.
Inhalation:
Remove from exposure and move to fresh air immediately. If not breathing, give artificial respiration. If breathing is difficult, give oxygen. Get medical aid.
Notes to Physician:

Section 5 - FIRE FIGHTING MEASURES
General Information:
As in any fire, wear a self-contained breathing apparatus in pressure-demand, MSHA/NIOSH (approved or equivalent), and full protective gear. During a fire, irritating and highly toxic gases may be generated by thermal decomposition or combustion.
Extinguishing Media:
Use water spray, dry chemical, carbon dioxide, or appropriate foam.

Section 6 - ACCIDENTAL RELEASE MEASURES
General Information: Use proper personal protective equipment as indicated in Section 8.
Spills/Leaks:
Avoid runoff into storm sewers and ditches which lead to waterways.
Clean up spills immediately, observing precautions in the Protective Equipment section. Sweep up or absorb material, then place into a suitable clean, dry, closed container for disposal. Provide ventilation.

Section 7 - HANDLING and STORAGE
Handling:
Wash thoroughly after handling. Remove contaminated clothing and wash before reuse. Avoid contact with eyes, skin, and clothing. Keep container tightly closed. Avoid ingestion and inhalation. Use with adequate ventilation.
Storage:
Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances.

Section 8 - EXPOSURE CONTROLS, PERSONAL PROTECTION
Engineering Controls:
Use adequate ventilation to keep airborne concentrations low.
Exposure Limits CAS# 4052-92-0: Personal Protective Equipment Eyes: Wear appropriate protective eyeglasses or chemical safety goggles as described by OSHA's eye and face protection regulations in 29 CFR 1910.133 or European Standard EN166.
Skin:
Wear appropriate protective gloves to prevent skin exposure.
Clothing:
Wear appropriate protective clothing to prevent skin exposure.
Respirators:
Follow the OSHA respirator regulations found in 29 CFR 1910.134 or European Standard EN 149. Use a NIOSH/MSHA or European Standard EN 149 approved respirator if exposure limits are exceeded or if irritation or other symptoms are experienced.

Section 9 - PHYSICAL AND CHEMICAL PROPERTIES

Physical State: Liquid
Color: almost colorless
Odor: Not available.
pH: Not available.
Vapor Pressure: Not available.
Viscosity: Not available.
Boiling Point: Not available.
Freezing/Melting Point: 18.00 - 20.00 deg C
Autoignition Temperature: Not available.
Flash Point: Not available.
Explosion Limits, lower: N/A
Explosion Limits, upper: N/A
Decomposition Temperature:
Solubility in water: decomposes
Specific Gravity/Density:
Molecular Formula: C7H4Cl2O3S
Molecular Weight: 239.08

Section 10 - STABILITY AND REACTIVITY
Chemical Stability:
Stable under normal temperatures and pressures.
Conditions to Avoid:
Incompatible materials, strong oxidants.
Incompatibilities with Other Materials:
Strong oxidizing agents.
Hazardous Decomposition Products:
Chlorine, carbon monoxide, oxides of sulfur, carbon dioxide, chloride fumes.
Hazardous Polymerization: Has not been reported

Section 11 - TOXICOLOGICAL INFORMATION
RTECS#:
CAS# 4052-92-0: DM6636400 LD50/LC50:
CAS# 4052-92-0: Draize test, rabbit, eye: 50 uL Moderate; Oral, rat: LD50 = 1780 mg/kg.
Carcinogenicity:
3-(Chlorosulfonyl)benzoyl Chloride - Not listed by ACGIH, IARC, or NTP.
Other:
See actual entry in RTECS for complete information.

Section 12 - ECOLOGICAL INFORMATION


Section 13 - DISPOSAL CONSIDERATIONS
Dispose of in a manner consistent with federal, state, and local regulations.

Section 14 - TRANSPORT INFORMATION

IATA
Shipping Name: CORROSIVE SOLID, ACIDIC, ORGANIC, N.O.S.*
Hazard Class: 8
UN Number: 3261
Packing Group: III
IMO
Shipping Name: CORROSIVE SOLID, ACIDIC, ORGANIC, N.O.S.
Hazard Class: 8
UN Number: 3261
Packing Group: III
RID/ADR
Shipping Name: CORROSIVE SOLID, ACIDIC, ORGANIC, N.O.S.
Hazard Class: 8
UN Number: 3261
Packing group: III

Section 15 - REGULATORY INFORMATION

European/International Regulations
European Labeling in Accordance with EC Directives
Hazard Symbols: Not available.
Risk Phrases:
Safety Phrases:
S 26 In case of contact with eyes, rinse immediately
with plenty of water and seek medical advice.
S 28A After contact with skin, wash immediately with
plenty of water.
S 37 Wear suitable gloves.
S 45 In case of accident or if you feel unwell, seek
medical advice immediately (show the label where
possible).
WGK (Water Danger/Protection)
CAS# 4052-92-0: No information available.
Canada
CAS# 4052-92-0 is listed on Canada's NDSL List.
CAS# 4052-92-0 is not listed on Canada's Ingredient Disclosure List.
US FEDERAL
TSCA
CAS# 4052-92-0 is listed on the TSCA inventory.


SECTION 16 - ADDITIONAL INFORMATION
N/A

 Safety Information

Hazard Codes Xn
Risk Phrases R36/37/38
Safety Phrases S26;S37/S39
HS Code 2916399090

 Synthetic Route

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3-(Chlorosulfonyl)benzoyl chloride Structure

3-(Chlorosulfon...

CAS#:4052-92-0

Literature: Shin, Jai Moo; Sachs, George; Cho, Young-Moon; Garst, Michael Molecules, 2009 , vol. 14, # 12 p. 5247 - 5280

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3-(Chlorosulfonyl)benzoyl chloride Structure

3-(Chlorosulfon...

CAS#:4052-92-0

Literature: Sanofi Patent: US5849780 A1, 1998 ; US 5849780 A

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3-(Chlorosulfonyl)benzoyl chloride Structure

3-(Chlorosulfon...

CAS#:4052-92-0

Literature: Wegscheider; Furcht Monatshefte fuer Chemie, 1902 , vol. 23, p. 1126,1128 Full Text Show Details Limpricht; v. Uslar Justus Liebigs Annalen der Chemie, 1857 , vol. 102, p. 250,251

 Customs

HS Code 2916399090
Summary 2916399090 other aromatic monocarboxylic acids, their anhydrides, halides, peroxides, peroxyacids and their derivatives VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%

 Synonyms

3-(Chlorsulfonyl)benzolcarbonylchlorid
3-(Chlorosulfonyl)benzoyl chloride
MFCD00051352
Benzoyl chloride, 3-(chlorosulfonyl)-
3-chlorosulfonylbenzoyl chloride
EINECS 223-759-1
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