Methyl 2-fluoro-4-formylbenzoate

Modify Date: 2024-01-28 09:15:07

Methyl 2-fluoro-4-formylbenzoate Structure
Methyl 2-fluoro-4-formylbenzoate structure
Common Name Methyl 2-fluoro-4-formylbenzoate
CAS Number 85070-58-2 Molecular Weight 182.14800
Density N/A Boiling Point N/A
Molecular Formula C9H7FO3 Melting Point N/A
MSDS N/A Flash Point N/A

 Names

Name Methyl 2-fluoro-4-formylbenzoate
Synonym More Synonyms

 Chemical & Physical Properties

Molecular Formula C9H7FO3
Molecular Weight 182.14800
Exact Mass 182.03800
PSA 43.37000
LogP 1.42480

 MSDS

Material Safety Data Sheet

Section1. Identification of the substance
Product Name: Methyl 2-fluoro-4-formylbenzoate
Synonyms:

Section2. Hazards identification
Harmful by inhalation, in contact with skin, and if swallowed.

Section3. Composition/information on ingredients.
Ingredient name:Methyl 2-fluoro-4-formylbenzoate
CAS number:85070-58-2

Section4. First aid measures
Skin contact:Immediately wash skin with copious amounts of water for at least 15 minutes while removing
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.
Store in closed vessels, refrigerated.
Storage:

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
Appearance:Not specified
Boiling point:No data
No data
Melting point:
Flash point:No data
Density:No data
Molecular formula:C9H7FO3
Molecular weight:182.1

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
Non-harzardous for air and ground transportation.

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

Hazard Codes Xi
HS Code 2918300090

 Synthetic Route

~70%

Methyl 2-fluoro-4-formylbenzoate Structure

Methyl 2-fluoro...

CAS#:85070-58-2

Literature: Giranda, Vincent L.; Penning, Thomas D.; Gandhi, Virajkamar B.; Thomas, Sheela A.; Zhu, Gui-Dong; Gong, Jianchun Patent: US2007/259937 A1, 2007 ; Location in patent: Page/Page column 13 ;

~73%

Methyl 2-fluoro-4-formylbenzoate Structure

Methyl 2-fluoro...

CAS#:85070-58-2

Literature: INCYTE CORPORATION; RODGERS, James, D.; LI, Yun-Long; SHEPARD, Stacey; WANG, Haisheng Patent: WO2011/28685 A1, 2011 ; Location in patent: Page/Page column 75 ; WO 2011/028685 A1

~%

Methyl 2-fluoro-4-formylbenzoate Structure

Methyl 2-fluoro...

CAS#:85070-58-2

Literature: INCYTE CORPORATION; RODGERS, James, D.; LI, Yun-Long; SHEPARD, Stacey; WANG, Haisheng Patent: WO2011/28685 A1, 2011 ; WO 2011/028685 A1

~%

Methyl 2-fluoro-4-formylbenzoate Structure

Methyl 2-fluoro...

CAS#:85070-58-2

Literature: Sakaki, Junichi; Kishida, Masashi; Konishi, Kazuhide; Gunji, Hiroki; Toyao, Atsushi; Matsumoto, Yuki; Kanazawa, Takanori; Uchiyama, Hidefumi; Fukaya, Hiroaki; Mitani, Hironobu; Arai, Yoshie; Kimura, Masaaki Bioorganic and Medicinal Chemistry Letters, 2007 , vol. 17, # 17 p. 4804 - 4807

~10%

Methyl 2-fluoro-4-formylbenzoate Structure

Methyl 2-fluoro...

CAS#:85070-58-2

Literature: Zimmerman, Sommer S.; Khatri, Alpa; Garnier-Amblard, Ethel C.; Mullasseril, Praseeda; Kurtkaya, Natalie L.; Gyoneva, Stefka; Hansen, Kasper B.; Traynelis, Stephen F.; Liotta, Dennis C. Journal of Medicinal Chemistry, 2014 , vol. 57, # 6 p. 2334 - 2356

~%

Methyl 2-fluoro-4-formylbenzoate Structure

Methyl 2-fluoro...

CAS#:85070-58-2

Literature: INCYTE CORPORATION; RODGERS, James, D.; LI, Yun-Long; SHEPARD, Stacey; WANG, Haisheng Patent: WO2011/28685 A1, 2011 ; WO 2011/028685 A1

~%

Methyl 2-fluoro-4-formylbenzoate Structure

Methyl 2-fluoro...

CAS#:85070-58-2

Literature: Zimmerman, Sommer S.; Khatri, Alpa; Garnier-Amblard, Ethel C.; Mullasseril, Praseeda; Kurtkaya, Natalie L.; Gyoneva, Stefka; Hansen, Kasper B.; Traynelis, Stephen F.; Liotta, Dennis C. Journal of Medicinal Chemistry, 2014 , vol. 57, # 6 p. 2334 - 2356

 Customs

HS Code 2918300090
Summary 2918300090 other carboxylic acids with aldehyde or ketone function but without other oxygen function, their anhydrides, halides, peroxides, peroxyacids and their derivatives。Supervision conditions:None。VAT:17.0%。Tax rebate rate:9.0%。MFN tariff:6.5%。General tariff:30.0%

 Synonyms

CL9183
methyl 2-fluoro-4-formyl-benzoate