Trans-2,4-Dichlorocinnamic Acid

Modify Date: 2024-01-02 13:34:46

Trans-2,4-Dichlorocinnamic Acid Structure
Trans-2,4-Dichlorocinnamic Acid structure
Common Name Trans-2,4-Dichlorocinnamic Acid
CAS Number 1201-99-6 Molecular Weight 217.049
Density 1.5±0.1 g/cm3 Boiling Point 359.4±27.0 °C at 760 mmHg
Molecular Formula C9H6Cl2O2 Melting Point 233-237ºC
MSDS N/A Flash Point 171.2±23.7 °C

 Names

Name Trans-2,4-Dichlorocinnamic Acid
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.5±0.1 g/cm3
Boiling Point 359.4±27.0 °C at 760 mmHg
Melting Point 233-237ºC
Molecular Formula C9H6Cl2O2
Molecular Weight 217.049
Flash Point 171.2±23.7 °C
Exact Mass 215.974487
PSA 37.30000
LogP 3.33
Vapour Pressure 0.0±0.8 mmHg at 25°C
Index of Refraction 1.638

 MSDS

Name: Trans-2 4-Dichlorocinnamic Acid 98% Material Safety Data Sheet
Synonym: 3-(2,4-Dichlorophenyl)-2-Propenoic Acid
CAS: 1201-99-6
Section 1 - Chemical Product MSDS Name:Trans-2 4-Dichlorocinnamic Acid 98% Material Safety Data Sheet
Synonym:3-(2,4-Dichlorophenyl)-2-Propenoic Acid

Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS
CAS# Chemical Name content EINECS#
1201-99-6 Trans-2,4-Dichlorocinnamic Acid 98 214-860-1
Hazard Symbols: XI
Risk Phrases: 37/38

Section 3 - HAZARDS IDENTIFICATION
EMERGENCY OVERVIEW
Irritating to respiratory system and skin.The toxicological properties of this material have not been fully investigated.
Potential Health Effects
Eye:
Causes eye irritation. May cause chemical conjunctivitis.
Skin:
Causes skin irritation.
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. Can produce delayed pulmonary edema.
Chronic:
Effects may be delayed.

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.
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.
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:
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.
Extinguishing Media:
Use agent most appropriate to extinguish fire. 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:
Vacuum or sweep up material and place into a suitable disposal container. Clean up spills immediately, observing precautions in the Protective Equipment section. Avoid generating dusty conditions.
Provide ventilation.

Section 7 - HANDLING and STORAGE
Handling:
Wash thoroughly after handling. Remove contaminated clothing and wash before reuse. Use with adequate ventilation. Minimize dust generation and accumulation. Avoid contact with eyes, skin, and clothing. Keep container tightly closed. Avoid ingestion and inhalation.
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.

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# 1201-99-6: 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: Powder
Color: white
Odor: none reported
pH: Not available.
Vapor Pressure: Not available.
Viscosity: Not available.
Boiling Point: Not available.
Freezing/Melting Point: 233.00 - 235.00 deg C
Autoignition Temperature: Not applicable.
Flash Point: Not applicable.
Explosion Limits, lower: Not available.
Explosion Limits, upper: Not available.
Decomposition Temperature:
Solubility in water:
Specific Gravity/Density:
Molecular Formula: C9H6Cl2O2
Molecular Weight: 217.05

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, dust generation, excess heat, strong oxidants.
Incompatibilities with Other Materials:
Oxidizing agents.
Hazardous Decomposition Products:
Hydrogen chloride, carbon monoxide, irritating and toxic fumes and gases, carbon dioxide.
Hazardous Polymerization: Has not been reported

Section 11 - TOXICOLOGICAL INFORMATION
RTECS#:
CAS# 1201-99-6: GD8575000 LD50/LC50:
Not available.
Carcinogenicity:
Trans-2,4-Dichlorocinnamic Acid - 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
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 37/38 Irritating to respiratory system and skin.
Safety Phrases:
S 28 After contact with skin, wash immediately
with...
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# 1201-99-6: No information available.
Canada
None of the chemicals in this product are listed on the DSL/NDSL list.
CAS# 1201-99-6 is not listed on Canada's Ingredient Disclosure List.
US FEDERAL
TSCA
CAS# 1201-99-6 is not listed on the TSCA inventory.
It is for research and development use only.


SECTION 16 - ADDITIONAL INFORMATION
N/A

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
GD8575000
CHEMICAL NAME :
Cinnamic acid, 2,4-dichloro-
CAS REGISTRY NUMBER :
1201-99-6
LAST UPDATED :
199206
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C9-H6-Cl2-O2
MOLECULAR WEIGHT :
217.05
WISWESSER LINE NOTATION :
QV1U1R BG DG

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
500 mg/kg
TOXIC EFFECTS :
Behavioral - altered sleep time (including change in righting reflex) Lungs, Thorax, or Respiration - other changes
REFERENCE :
CBCCT* "Summary Tables of Biological Tests," National Research Council Chemical-Biological Coordination Center. (National Academy of Science Library, 2101 Constitution Ave., NW, Washington, DC 20418) Volume(issue)/page/year: 4,377,1952

 Safety Information

Hazard Codes Xi:Irritant
Risk Phrases R37/38
Safety Phrases S28
WGK Germany 3

 Synthetic Route

~75%

Trans-2,4-Dichlorocinnamic Acid Structure

Trans-2,4-Dichl...

CAS#:1201-99-6

Literature: Tamiz, Amir P.; Cai, Sui Xiong; Zhou, Zhang-Lin; Yuen, Po-Wai; Schelkun, Robert M.; Whittemore, Edward R.; Weber, Eckard; Woodward, Richard M.; Keana, John F. W. Journal of Medicinal Chemistry, 1999 , vol. 42, # 17 p. 3412 - 3420

~94%

Trans-2,4-Dichlorocinnamic Acid Structure

Trans-2,4-Dichl...

CAS#:1201-99-6

Literature: Sampath Kumar; Subbareddy; Anjaneyulu; Yadav Synthetic Communications, 1998 , vol. 28, # 20 p. 3811 - 3815

~%

Trans-2,4-Dichlorocinnamic Acid Structure

Trans-2,4-Dichl...

CAS#:1201-99-6

Literature: Journal of the American Chemical Society, , vol. 69, p. 718,721 Zhurnal Obshchei Khimii, , vol. 6, p. 508 Chem. Zentralbl., , vol. 108, # I p. 1931

~%

Trans-2,4-Dichlorocinnamic Acid Structure

Trans-2,4-Dichl...

CAS#:1201-99-6

Literature: Bioorganic and Medicinal Chemistry Letters, , vol. 22, # 9 p. 3163 - 3167

~%

Trans-2,4-Dichlorocinnamic Acid Structure

Trans-2,4-Dichl...

CAS#:1201-99-6

Literature: Bioorganic and Medicinal Chemistry Letters, , vol. 22, # 9 p. 3163 - 3167

~83%

Trans-2,4-Dichlorocinnamic Acid Structure

Trans-2,4-Dichl...

CAS#:1201-99-6

Literature: Sarti-Fantoni, P.; Donati, D.; Fiorenza, M.; Moschi, E.; Dal Piaz, V. Journal of Heterocyclic Chemistry, 1980 , vol. 17, p. 621 - 622

~%

Trans-2,4-Dichlorocinnamic Acid Structure

Trans-2,4-Dichl...

CAS#:1201-99-6

Literature: Journal of the Karnatak University, , vol. 3, p. 52

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Trans-2,4-Dichlorocinnamic Acid Structure

Trans-2,4-Dichl...

CAS#:1201-99-6

Literature: Journal of the Karnatak University, , vol. 3, p. 52

 Synonyms

MFCD00004373
2-Propenoic acid, 3-(2,4-dichlorophenyl)-, (2E)-
EINECS 214-860-1
2,4-Dichlorocinnamic acid
(2E)-3-(2,4-Dichlorophenyl)acrylic acid
trans-2,4-Dichlorocinnamicacid
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