1-Ethynyl-3,4-fluorobenzene

Modify Date: 2024-01-10 21:54:37

1-Ethynyl-3,4-fluorobenzene Structure
1-Ethynyl-3,4-fluorobenzene structure
Common Name 1-Ethynyl-3,4-fluorobenzene
CAS Number 143874-13-9 Molecular Weight 138.114
Density 1.2±0.1 g/cm3 Boiling Point 145.9±30.0 °C at 760 mmHg
Molecular Formula C8H4F2 Melting Point N/A
MSDS Chinese USA Flash Point 31.4±12.4 °C
Symbol GHS02
GHS02
Signal Word Danger

 Names

Name 3,4-Difluorophenylacetylene
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.2±0.1 g/cm3
Boiling Point 145.9±30.0 °C at 760 mmHg
Molecular Formula C8H4F2
Molecular Weight 138.114
Flash Point 31.4±12.4 °C
Exact Mass 138.028107
LogP 2.41
Vapour Pressure 6.0±0.3 mmHg at 25°C
Index of Refraction 1.492

 MSDS

Material Safety Data Sheet

Section1. Identification of the substance
Product Name: 3,4-Difluorophenylacetylene
Synonyms:

Section2. Hazards identification
Harmful by inhalation, in contact with skin, and if swallowed.
H225:Highly flammable liquid and vapour
P210:Keep away from heat/sparks/open flames/hot surfaces. No smoking

Section3. Composition/information on ingredients.
Ingredient name:3,4-Difluorophenylacetylene
CAS number:143874-13-9

Section4. First aid measures
Immediately wash skin with copious amounts of water for at least 15 minutes while removing
Skin contact:
contaminated clothing and shoes. If irritation persists, seek medical attention.
Eye contact:Immediately wash skin with copious amounts of water for at least 15 minutes. Assure adequate
flushing of the eyes by separating the eyelids with fingers. If irritation persists, seek medical
attention.
Inhalation:Remove to fresh air. In severe cases or if symptoms persist, seek medical attention.
Ingestion:Wash out mouth with copious amounts of water for at least 15 minutes. Seek medical attention.

Section5. Fire fighting measures
In the event of a fire involving this material, alone or in combination with other materials, use dry
powder or carbon dioxide extinguishers. Protective clothing and self-contained breathing apparatus
should be worn.

Section6. Accidental release measures
Personal precautions: Wear suitable personal protective equipment which performs satisfactorily and meets local/state/national
standards.
Respiratory precaution:Wear approved mask/respirator
Hand precaution:Wear suitable gloves/gauntlets
Skin protection:Wear suitable protective clothing
Eye protection:Wear suitable eye protection
Methods for cleaning up: Mix with sand or similar inert absorbent material, sweep up and keep in a tightly closed container
for disposal. See section 12.
Environmental precautions: Do not allow material to enter drains or water courses.

Section7. Handling and storage
Handling:This product should be handled only by, or under the close supervision of, those properly qualified
in the handling and use of potentially hazardous chemicals, who should take into account the fire,
health and chemical hazard data given on this sheet.
Storage:Store in closed vessels, refrigerated.

Section8. Exposure Controls / Personal protection
Engineering Controls: Use only in a chemical fume hood.
Personal protective equipment: Wear laboratory clothing, chemical-resistant gloves and safety goggles.
General hydiene measures: Wash thoroughly after handling. Wash contaminated clothing before reuse.

Section9. Physical and chemical properties
Not specified
Appearance:
Boiling point:No data
Melting point:No data
Flash point:No data
Density:No data
Molecular formula:C8H4F2
Molecular weight:138.1

Section10. Stability and reactivity
Conditions to avoid: Heat, flames and sparks.
Materials to avoid: Oxidizing agents.
Possible hazardous combustion products: Carbon monoxide, hydrogen fluoride.

Section11. Toxicological information
No data.

Section12. Ecological information
No data.

Section13. Disposal consideration
Arrange disposal as special waste, by licensed disposal company, in consultation with local waste
disposal authority, in accordance with national and regional regulations.

Section14. Transportation information
UN Number:UN1993Class: 3Packing group: II
Proper shipping name: FLAMMABLE LIQUIDS, N.O.S. (3,4-Difluorophenylacetylene)

Section15. Regulatory information
No chemicals in this material are subject to the reporting requirements of SARA Title III, Section
302, or have known CAS numbers that exceed the threshold reporting levels established by SARA
Title III, Section 313.


SECTION 16 - ADDITIONAL INFORMATION
N/A

 Safety Information

Symbol GHS02
GHS02
Signal Word Danger
Hazard Statements H225
Precautionary Statements P210
Personal Protective Equipment Eyeshields;Faceshields;full-face respirator (US);Gloves;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter
Hazard Codes F: Flammable;
Risk Phrases R11
RIDADR UN 1993 3/PG 2
HS Code 2903999090

 Synthetic Route

~76%

1-Ethynyl-3,4-fluorobenzene Structure

1-Ethynyl-3,4-f...

CAS#:143874-13-9

Literature: ELI LILLY AND COMPANY Patent: WO2005/94822 A1, 2005 ; Location in patent: Page/Page column 31-32 ; WO 2005/094822 A1

~%

1-Ethynyl-3,4-fluorobenzene Structure

1-Ethynyl-3,4-f...

CAS#:143874-13-9

Literature: WO2013/90210 A1, ;

 Customs

HS Code 2903999090
Summary 2903999090 halogenated derivatives of aromatic hydrocarbons VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:5.5% General tariff:30.0%

 Synonyms

3,4-Difluorophenylacetylene
1-Ethynyl-3,4-fluorobenzene
4-Ethynyl-1,2-difluorobenzene
Benzene, 4-ethynyl-1,2-difluoro-