4-(Trifluoromethoxy)benzyl chloride

Modify Date: 2024-01-02 16:26:41

4-(Trifluoromethoxy)benzyl chloride Structure
4-(Trifluoromethoxy)benzyl chloride structure
Common Name 4-(Trifluoromethoxy)benzyl chloride
CAS Number 65796-00-1 Molecular Weight 210.581
Density 1.3±0.1 g/cm3 Boiling Point 189.8±35.0 °C at 760 mmHg
Molecular Formula C8H6ClF3O Melting Point N/A
MSDS N/A Flash Point 68.6±25.9 °C

 Names

Name 4-(Trifluoromethoxy)benzyl chloride
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.3±0.1 g/cm3
Boiling Point 189.8±35.0 °C at 760 mmHg
Molecular Formula C8H6ClF3O
Molecular Weight 210.581
Flash Point 68.6±25.9 °C
Exact Mass 210.005920
PSA 9.23000
LogP 3.44
Vapour Pressure 0.8±0.3 mmHg at 25°C
Index of Refraction 1.460
Storage condition Refrigerator

 MSDS

Name: 1-(Chloromethyl)-4-(trifluoromethoxy)benzene, 97% Material Safety Data Sheet
Synonym: 4-(Trifluoromethoxy)benzyl chloride
CAS: 65796-00-1
Section 1 - Chemical Product MSDS Name: 1-(Chloromethyl)-4-(trifluoromethoxy)benzene, 97% Material Safety Data Sheet
Synonym: 4-(Trifluoromethoxy)benzyl chloride
SECTION 2 - COMPOSITION, INFORMATION ON INGREDIENTS
CAS# Chemical Name content EINECS#
65796-00-1 1-(Chloromethyl)-4-(trifluoromethoxy)b 97% unlisted
+++++
Hazard Symbols: C
SECTION 3 - HAZARDS IDENTIFICATION EMERGENCY OVERVIEW Causes burns. Potential Health Effects
Eye:
Causes eye burns.
Skin:
Causes skin burns.
Ingestion:
Causes gastrointestinal tract burns.
Inhalation:
Causes chemical burns to the respiratory tract.
Chronic:
Not available.
SECTION 4 - FIRST AID MEASURES
Eyes:
Immediately 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 immediately. Immediately flush skin with plenty of water for at least 15 minutes while removing contaminated clothing and shoes.
Ingestion:
Do not induce vomiting. Get medical aid immediately.
Inhalation:
Get medical aid immediately. Remove from exposure and move to fresh air immediately. If not breathing, give artificial respiration. If breathing is difficult, give oxygen.
Notes to Physician:
Treat symptomatically and supportively.
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.
Extinguishing Media:
Use foam, dry chemical, or carbon dioxide.
SECTION 6 - ACCIDENTAL RELEASE MEASURES
General Information: Use proper personal protective equipment as indicated in Section 8.
Spills/Leaks:
Absorb spill with inert material (e.g. vermiculite, sand or earth), then place in suitable container.
SECTION 7 - HANDLING and STORAGE
Handling:
Do not breathe dust, vapor, mist, or gas. Do not get in eyes, on skin, or on clothing. Use only in a chemical fume hood.
Storage:
Store in a cool, dry place. Store in a tightly closed container. Corrosives area.
SECTION 8 - EXPOSURE CONTROLS, PERSONAL PROTECTION
Engineering Controls:
Facilities storing or utilizing this material should be equipped with an eyewash facility and a safety shower. Use adequate ventilation to keep airborne concentrations low. Exposure Limits CAS# 65796-00-1: Personal Protective Equipment
Eyes:
Not available.
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: colorless
Odor: Not available.
pH: Not available.
Vapor Pressure: Not available.
Viscosity: Not available.
Boiling Point: 81 - 83 deg C @15mmHg
Freezing/Melting Point: Not available.
Autoignition Temperature: Not available.
Flash Point: Not available.
Explosion Limits, lower: Not available.
Explosion Limits, upper: Not available.
Decomposition Temperature: Not available.
Solubility in water:
Specific Gravity/Density:
Molecular Formula: C8H6ClF3O
Molecular Weight: 211
SECTION 10 - STABILITY AND REACTIVITY
Chemical Stability:
Not available.
Conditions to Avoid:
Incompatible materials.
Incompatibilities with Other Materials:
Oxidizing agents, bases, amines.
Hazardous Decomposition Products:
Hydrogen chloride, chlorine, carbon monoxide, carbon dioxide, fluorine, hydrogen fluoride gas.
Hazardous Polymerization: Has not been reported
SECTION 11 - TOXICOLOGICAL INFORMATION RTECS#: CAS# 65796-00-1 unlisted.
LD50/LC50:
Not available.
Carcinogenicity:
1-(Chloromethyl)-4-(trifluoromethoxy)benzene - Not listed by ACGIH, IARC, or NTP.
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 LIQUID, ACIDIC, ORGANIC, N.O.S.
Hazard Class: 8
UN Number: 3265
Packing Group: III IMO
Shipping Name: CORROSIVE LIQUID, ACIDIC, ORGANIC, N.O.S.
Hazard Class: 8
UN Number: 3265
Packing Group: III RID/ADR
Shipping Name: CORROSIVE LIQUID, ACIDIC, ORGANIC, N.O.S.
Hazard Class: 8
UN Number: 3265
Packing group: III
SECTION 15 - REGULATORY INFORMATION European/International Regulations European Labeling in Accordance with EC Directives
Hazard Symbols: C
Risk Phrases:
R 34 Causes burns.
Safety Phrases:
S 26 In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. S 36/37/39 Wear suitable protective clothing, gloves and eye/face protection. 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# 65796-00-1: No information available. Canada None of the chemicals in this product are listed on the DSL/NDSL list. CAS# 65796-00-1 is not listed on Canada's Ingredient Disclosure List. US FEDERAL TSCA CAS# 65796-00-1 is not listed on the TSCA inventory. It is for research and development use only.
SECTION 16 - ADDITIONAL INFORMATION
MSDS Creation Date: 3/21/2003 Revision #0 Date: Original. The information above is believed to be accurate and represents the best information currently available to us. However, we make no warranty of merchantability or any other warranty, express or implied, with respect to such information, and we assume no liability resulting from its use. Users should make their own investigations to determine the suitability of the information for their particular purposes. In no way shall the company be liable for any claims, losses, or damages of any third party or for lost profits or any special, indirect, incidental, consequential or exemplary damages, howsoever arising, even if the company has been advised of the possibility of such damages.

SECTION 16 - ADDITIONAL INFORMATION
N/A

 Safety Information

Hazard Codes C:Corrosive;
Risk Phrases R34
Safety Phrases S26-S36/37/39-S45
RIDADR 1760
HS Code 2909309090

 Synthetic Route

~66%

4-(Trifluoromethoxy)benzyl chloride Structure

4-(Trifluoromet...

CAS#:65796-00-1

Literature: Marhold, Albrecht; Muller, Peter Patent: US2002/82454 A1, 2002 ;

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4-(Trifluoromethoxy)benzyl chloride Structure

4-(Trifluoromet...

CAS#:65796-00-1

Literature: US4178460 A1, ;

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4-(Trifluoromethoxy)benzyl chloride Structure

4-(Trifluoromet...

CAS#:65796-00-1

Literature: EP1300464 A1, ;

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4-(Trifluoromethoxy)benzyl chloride Structure

4-(Trifluoromet...

CAS#:65796-00-1

Literature: Journal of medicinal chemistry, , vol. 13, # 5 p. 820 - 826

 Customs

HS Code 2909309090
Summary 2909309090 other aromatic ethers and their halogenated, sulphonated, nitrated or nitrosated derivatives VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:5.5% General tariff:30.0%

 Synonyms

4-(Chloromethyl)phenyl trifluoromethyl ether
4-(Trifluoromethoxy)benzyl chloride
1-(Chloromethyl)-4-(trifluoromethoxy)benzene
MFCD00052326
G1R DOXFFF
Benzene, 1-(chloromethyl)-4-(trifluoromethoxy)-
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