2,2,2-trifluoroacetyl isocyanate

Modify Date: 2024-01-12 13:28:51

2,2,2-trifluoroacetyl isocyanate Structure
2,2,2-trifluoroacetyl isocyanate structure
Common Name 2,2,2-trifluoroacetyl isocyanate
CAS Number 14565-32-3 Molecular Weight 139.03300
Density 1.47g/cm3 Boiling Point 39ºC at 760mmHg
Molecular Formula C3F3NO2 Melting Point N/A
MSDS N/A Flash Point N/A

 Names

Name 2,2,2-trifluoroacetyl isocyanate
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.47g/cm3
Boiling Point 39ºC at 760mmHg
Molecular Formula C3F3NO2
Molecular Weight 139.03300
Exact Mass 138.98800
PSA 46.50000
LogP 0.41110
Vapour Pressure 447mmHg at 25°C
Index of Refraction 1.37

 MSDS

Name: Trifluoroacetylisocyanate Material Safety Data Sheet
Synonym: None
CAS: 14565-32-3
Section 1 - Chemical Product MSDS Name:Trifluoroacetylisocyanate Material Safety Data Sheet
Synonym:None

Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS
CAS# Chemical Name content EINECS#
14565-32-3 Trifluoroacetylisocyanate 100 unlisted
Hazard Symbols: XI
Risk Phrases: 36/37/38

Section 3 - HAZARDS IDENTIFICATION
EMERGENCY OVERVIEW
Irritating to eyes, respiratory system and skin.Moisture sensitive.Stench.
Potential Health Effects
Eye:
Causes eye irritation. Lachrymator (substance which increases the flow of tears). May cause chemical conjunctivitis.
Skin:
Causes skin irritation. May cause skin sensitization, an allergic reaction, which becomes evident upon re-exposure to this material.
Ingestion:
May cause gastrointestinal irritation with nausea, vomiting and diarrhea. The toxicological properties of this substance have not been fully investigated.
Inhalation:
Causes respiratory tract irritation. The toxicological properties of this substance have not been fully investigated. Exposure produces central nervous system depression. At high concentrations, isocyanates affect mucous membranes of the respiratory tract and may lead to fatal pulmonary edema. Exposure to low and often even unmeasurable isocyanate concentration results in sensitization.
Chronic:
May cause lung damage. Inhalation of product may aggravate existing chronic repiratory problems such as asthma, emphysema or bronchitis.

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. Do NOT allow victim to rub eyes or keep eyes closed.
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:
Never give anything by mouth to an unconscious person. Get medical aid. Do NOT induce vomiting. If conscious and alert, rinse mouth and drink 2-4 cupfuls of milk or water. Wash mouth out with water.
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. Do NOT use mouth-to-mouth resuscitation.
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. During a fire, irritating and highly toxic gases may be generated by thermal decomposition or combustion. Vapors may be heavier than air. They can spread along the ground and collect in low or confined areas. Runoff from fire control or dilution water may cause pollution.
Extinguishing Media:
Use water spray, dry chemical, carbon dioxide, or chemical foam. Do NOT get water inside containers.

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. Clean up spills immediately, observing precautions in the Protective Equipment section. Provide ventilation. Do not get water inside containers.

Section 7 - HANDLING and STORAGE
Handling:
Remove contaminated clothing and wash before reuse. Use with adequate ventilation. Avoid breathing dust, vapor, mist, or gas.
Avoid contact with eyes, skin, and clothing. Keep container tightly closed. Do not allow contact with water. Keep from contact with moist air and steam.
Storage:
Store in a cool, dry place. Store in a tightly closed container.
Store in a cool, dry, well-ventilated area away from incompatible substances. Store protected from moisture.

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# 14565-32-3: 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: colorless
Odor: stench
pH: Not available.
Vapor Pressure: Not available.
Viscosity: Not available.
Boiling Point: 37.5 deg C @ 760 mmHg
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:
Solubility in water:
Specific Gravity/Density:
Molecular Formula: C3F3NO2
Molecular Weight: 139.04

Section 10 - STABILITY AND REACTIVITY
Chemical Stability:
Stable at room temperature in closed containers under normal storage and handling conditions.
Conditions to Avoid:
Moisture, excess heat.
Incompatibilities with Other Materials:
Strong oxidizing agents.
Hazardous Decomposition Products:
Hydrogen cyanide, nitrogen oxides, carbon monoxide, carbon dioxide, hydrogen fluoride gas, hydrocarbons.
Hazardous Polymerization: Has not been reported

Section 11 - TOXICOLOGICAL INFORMATION
RTECS#:
CAS# 14565-32-3 unlisted.
LD50/LC50:
Not available.
Carcinogenicity:
Trifluoroacetylisocyanate - 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
Not regulated as a hazardous material.
IMO
Not regulated as a hazardous material.
RID/ADR
Not regulated as a hazardous material.

Section 15 - REGULATORY INFORMATION

European/International Regulations
European Labeling in Accordance with EC Directives
Hazard Symbols: XI
Risk Phrases:
R 36/37/38 Irritating to eyes, respiratory system
and skin.
Safety Phrases:
S 26 In case of contact with eyes, rinse immediately
with plenty of water and seek medical advice.
S 37/39 Wear suitable gloves and eye/face
protection.
WGK (Water Danger/Protection)
CAS# 14565-32-3: No information available.
Canada
None of the chemicals in this product are listed on the DSL/NDSL list.
CAS# 14565-32-3 is not listed on Canada's Ingredient Disclosure List.
US FEDERAL
TSCA
CAS# 14565-32-3 is not listed on the TSCA inventory.
It is for research and development use only.


SECTION 16 - ADDITIONAL INFORMATION
N/A

 Safety Information

HS Code 2929109000

 Synthetic Route

~38%

2,2,2-trifluoroacetyl isocyanate Structure

2,2,2-trifluoro...

CAS#:14565-32-3

Literature: Arbuzov, B. A.; Zobova, N. N.; Andronova, I. I. Izvestiya Akademii Nauk SSSR, Seriya Khimicheskaya, 1974 , p. 1484 - 1487 Izvestiya Akademii Nauk SSSR, Seriya Khimicheskaya, 1974 , p. 1566 - 1570 C.A., 1974 , vol. 81, p. 169072

~65%

2,2,2-trifluoroacetyl isocyanate Structure

2,2,2-trifluoro...

CAS#:14565-32-3

Literature: Kiemstedt, Wolfgang; Sundermeyer, Wolfgang Chemische Berichte, 1982 , vol. 115, # 3 p. 919 - 925

~%

2,2,2-trifluoroacetyl isocyanate Structure

2,2,2-trifluoro...

CAS#:14565-32-3

Literature: Barrett, Anthony G. M.; Betts, Michael J.; Fenwick, Ashley Journal of Organic Chemistry, 1985 , vol. 50, # 2 p. 169 - 175

~36%

2,2,2-trifluoroacetyl isocyanate Structure

2,2,2-trifluoro...

CAS#:14565-32-3

Literature: Firth, W. C. Journal of Organic Chemistry, 1968 , vol. 33, p. 441 - 442 Full Text View citing articles Show Details American Cyanamid Comp. Patent: US3541120 , 1970 ; C.A., 1971 , vol. 74, p. 31545

~%

2,2,2-trifluoroacetyl isocyanate Structure

2,2,2-trifluoro...

CAS#:14565-32-3

Literature: Ye; Noftle Journal of Fluorine Chemistry, 1997 , vol. 81, # 2 p. 193 - 196

~%

2,2,2-trifluoroacetyl isocyanate Structure

2,2,2-trifluoro...

CAS#:14565-32-3

Literature: Ye; Noftle Journal of Fluorine Chemistry, 1997 , vol. 81, # 2 p. 193 - 196

~%

2,2,2-trifluoroacetyl isocyanate Structure

2,2,2-trifluoro...

CAS#:14565-32-3

Literature: Durig, J. R.; Guirgis, G. A.; Krutules, K. A. Journal of Molecular Structure, 1994 , vol. 328, p. 55 - 76

 Customs

HS Code 2929109000
Summary 2929109000. other isocyanates. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%

 Synonyms

Trifluormethylcarbonylaminocarbonyl
TRIFLUOROACETYLISOCYANATE
Trifluoracetyl-isocyanat
Trifluormethylcarbonyl-isocyanat