QVXFFF &&d(acid)

Modify Date: 2024-01-02 18:21:45

QVXFFF &&d(acid) Structure
QVXFFF &&d(acid) structure
Common Name QVXFFF &&d(acid)
CAS Number 599-00-8 Molecular Weight 115.030
Density 1.6±0.1 g/cm3 Boiling Point 72.2±35.0 °C at 760 mmHg
Molecular Formula C2DF3O2 Melting Point -15ºC
MSDS Chinese USA Flash Point -2.5±25.9 °C
Symbol GHS05 GHS07
GHS05, GHS07
Signal Word Danger

 Names

Name Trifluoroacetic acid-d
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.6±0.1 g/cm3
Boiling Point 72.2±35.0 °C at 760 mmHg
Melting Point -15ºC
Molecular Formula C2DF3O2
Molecular Weight 115.030
Flash Point -2.5±25.9 °C
Exact Mass 114.999138
PSA 37.30000
LogP 1.24
Vapour Pressure 96.2±0.2 mmHg at 25°C
Index of Refraction 1.294

 MSDS

Name: Trifluoroacetic Acid-D 99.5 Atom% D Material Safety Data Sheet
Synonym: TFA-
CAS: 599-00-8
Section 1 - Chemical Product MSDS Name:Trifluoroacetic Acid-D 99.5 Atom% D Material Safety Data Sheet
Synonym:TFA-

Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS
CAS# Chemical Name content EINECS#
599-00-8 Trifluoroacetic Acid-D 99.5 209-961-2
Hazard Symbols: C
Risk Phrases: 35 20

Section 3 - HAZARDS IDENTIFICATION
EMERGENCY OVERVIEW
Causes severe burns. Harmful by inhalation.Corrosive.
Potential Health Effects
Eye:
Causes eye burns. May cause chemical conjunctivitis and corneal damage.
Skin:
Causes skin burns. May be absorbed through the skin. May cause skin rash (in milder cases), and cold and clammy skin with cyanosis or pale color.
Ingestion:
May cause severe and permanent damage to the digestive tract. Causes gastrointestinal tract burns. May cause perforation of the digestive tract. The toxicological properties of this substance have not been fully investigated. Ingestion of large amounts of fluoride may cause salivation, nausea, vomiting, abdominal pain, fever, labored breathing. Exposure to fluoride compounds can result in systemic toxic effects on the heart, liver, and kidneys. It may also deplete calcium levels in the body leading to hypocalcemia and death.
Fluoride can reduce calcium levels leading to fatal hypocalcemia.
May cause systemic effects.
Inhalation:
Causes chemical burns to the respiratory tract. The toxicological properties of this substance have not been fully investigated.
Aspiration may lead to pulmonary edema. May cause systemic effects.
Chronic:
Chronic inhalation and ingestion may cause chronic fluoride poisoning (fluorosis) characterized by weight loss, weakness, anemia, brittle bones, and stiff joints. Effects may be delayed.
Chronic exposure to fluoride compounds may cause systemic toxicity.

Section 4 - FIRST AID MEASURES
Eyes: Get medical aid immediately. Do NOT allow victim to rub eyes or keep eyes closed. Extensive irrigation with water is required (at least 30 minutes).
Skin:
Get medical aid immediately. Immediately flush skin with plenty of water for at least 15 minutes while removing contaminated clothing and shoes. Wash clothing before reuse. Destroy contaminated shoes.
Ingestion:
Do not induce vomiting. 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:
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. Do NOT use mouth-to-mouth resuscitation. If breathing has ceased apply artificial respiration using oxygen and a suitable mechanical device such as a bag and a mask.
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. Can burn in a fire, releasing toxic vapors. During a fire, irritating and highly toxic gases may be generated by thermal decomposition or combustion. Use water spray to keep fire-exposed containers cool. Containers may explode in the heat of a fire. Vapors may be heavier than air. They can spread along the ground and collect in low or confined areas.
Extinguishing Media:
Use agent most appropriate to extinguish fire. Do NOT get water inside containers. Cool containers with flooding quantities of water until well after fire is out. 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. Absorb spill using an absorbent, non-combustible material such as earth, sand, or vermiculite. Do not use combustible materials such as sawdust. Provide ventilation. Do not get water inside containers.

Section 7 - HANDLING and STORAGE
Handling:
Wash thoroughly after handling. Use with adequate ventilation. Do not breathe dust, vapor, mist, or gas. Do not get in eyes, on skin, or on clothing. Keep container tightly closed. Avoid ingestion and inhalation. Discard contaminated shoes.
Storage:
Keep container closed when not in use. Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances. 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 process enclosure, local exhaust ventilation, or other engineering controls to control airborne levels.
Exposure Limits CAS# 599-00-8: 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:
A respiratory protection program that meets OSHA's 29 CFR 1910.134 and ANSI Z88.2 requirements or European Standard EN 149 must be followed whenever workplace conditions warrant respirator use.

Section 9 - PHYSICAL AND CHEMICAL PROPERTIES

Physical State: Liquid
Color: clear colorless to faint yellow
Odor: acetic odor
pH: acidic
Vapor Pressure: 4.0 mm Hg @ 0C
Viscosity: Not available.
Boiling Point: 75 deg C
Freezing/Melting Point: -15 deg C
Autoignition Temperature: Not available.
Flash Point: Not available.
Explosion Limits, lower: Not available.
Explosion Limits, upper: Not available.
Decomposition Temperature:
Solubility in water: Moderately Soluble.
Specific Gravity/Density: 1.493
Molecular Formula: C2DF3O2
Molecular Weight: 115.008

Section 10 - STABILITY AND REACTIVITY
Chemical Stability:
Stable at room temperature in closed containers under normal storage and handling conditions.
Conditions to Avoid:
Incompatible materials, ignition sources, acids, strong oxidants, bases.
Incompatibilities with Other Materials:
Oxidizing agents.
Hazardous Decomposition Products:
Carbon monoxide, irritating and toxic fumes and gases, carbon dioxide, fluoride fumes, hydrogen fluoride gas.
Hazardous Polymerization: Has not been reported

Section 11 - TOXICOLOGICAL INFORMATION
RTECS#:
CAS# 599-00-8 unlisted.
LD50/LC50:
Not available.
Carcinogenicity:
Trifluoroacetic Acid-D - 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
No information available.
IMO
No information available.
RID/ADR
No information available.

Section 15 - REGULATORY INFORMATION

European/International Regulations
European Labeling in Accordance with EC Directives
Hazard Symbols: C
Risk Phrases:
R 20 Harmful by inhalation.
R 35 Causes severe burns.
Safety Phrases:
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# 599-00-8: No information available.
Canada
CAS# 599-00-8 is listed on Canada's NDSL List.
CAS# 599-00-8 is not listed on Canada's Ingredient Disclosure List.
US FEDERAL
TSCA
CAS# 599-00-8 is listed on the TSCA inventory.


SECTION 16 - ADDITIONAL INFORMATION
N/A

 Safety Information

Symbol GHS05 GHS07
GHS05, GHS07
Signal Word Danger
Hazard Statements H314-H332
Precautionary Statements P280-P305 + P351 + P338-P310
Personal Protective Equipment Faceshields;full-face respirator (US);Gloves;Goggles;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter
Hazard Codes C:Corrosive;
Risk Phrases R20;R35;R52/53
Safety Phrases S26-S27-S28-S45-S61-S9
RIDADR UN 2699 8/PG 1
WGK Germany 3
Packaging Group I
Hazard Class 8.0

 Synthetic Route

~99%

QVXFFF &&d(acid) Structure

QVXFFF &&d(acid)

CAS#:599-00-8

Literature: Dannenberg, J.J.; Goldberg, B.J.; Barton, J.K.; Dill, K.; Weinwurzel, D.H.; Longas, M.O. Journal of the American Chemical Society, 1981 , vol. 103, # 26 p. 7764 - 7768

~%

QVXFFF &&d(acid) Structure

QVXFFF &&d(acid)

CAS#:599-00-8

Literature: Chemistry of Heterocyclic Compounds (New York, NY, United States), , vol. 21, # 4 p. 438 - 442 Khimiya Geterotsiklicheskikh Soedinenii, , vol. 21, # 4 p. 525 - 529

 Articles10

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Conformations of cyclic peptides. IV. Nuclear magnetic resonance studies of cyclo-pentaglycyl-L-leucyl and cyclo-diglycyl-L-histidyldiglycyl-L-tyrosyl.

Biochemistry 8(10) , 4087-95, (1969)

Anti stereochemistry in protodesilylation of an optically active allylsilane with trifluoroacetic acid-D. Hayashi T, et al.

Tetrahedron Lett. 23(44) , 4605-6, (1982)

The Vapor Phase Dissociation of Some Carboxylic Acids. III. 1 Trifluoroacetic Acid and Trifluoroacetic Acid-d2, 3. Taylor MD and Templeman MB.

J. Am. Chem. Soc. 78(13) , 2950-53, (1956)

 Synonyms

Trifluoroacetic acid-D
Trifluoro(H)acetic acid
MFCD00044563
Deuterotrifluoroacetic acid
Trifluoro(2H)acetic acid
Trifluoroaceticaciddeuterated(TFA-D)
2,2,2-Trifluoroacetic acid-d
QVXFFF &&d(acid)
Acetic acid-d, 2,2,2-trifluoro-
Trifluoroacetic (2H)acid
EINECS 209-961-2
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