tert-Butyl methyl(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)carbamate

Modify Date: 2024-01-09 20:19:31

tert-Butyl methyl(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)carbamate Structure
tert-Butyl methyl(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)carbamate structure
Common Name tert-Butyl methyl(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)carbamate
CAS Number 916587-44-5 Molecular Weight 333.23000
Density N/A Boiling Point N/A
Molecular Formula C18H28BNO4 Melting Point N/A
MSDS N/A Flash Point N/A

 Names

Name tert-butyl N-methyl-N-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]carbamate
Synonym More Synonyms

 Chemical & Physical Properties

Molecular Formula C18H28BNO4
Molecular Weight 333.23000
Exact Mass 333.21100
PSA 48.00000
LogP 3.35710

 MSDS

Material Safety Data Sheet

Section1. Identification of the substance
Product Name: 4-(BOC-Methylamino)phenylboronic acid, pinacol ester
Synonyms:t-Butyl-n-methyl-n-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]carbamate

Section2. Hazards identification
Harmful by inhalation, in contact with skin, and if swallowed.
H317:May cause an allergic skin reaction
H413:May cause long lasting harmful effects to aquatic life
P280:Wear protective gloves/protective clothing/eye protection/face protection

Section3. Composition/information on ingredients.
Ingredient name:4-(BOC-Methylamino)phenylboronic acid, pinacol ester
CAS number:916587-44-5

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.
Storage:Store in closed vessels.

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
Melting point:No data
Flash point:No data
Density:No data
Molecular formula:C18H28BNO4
Molecular weight:333.2

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

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

 Synthetic Route

~72%

tert-Butyl methyl(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)carbamate Structure

tert-Butyl meth...

CAS#:916587-44-5

Literature: Taisho Pharmaceutical Co., Ltd.; Toyama Chemical Co., Ltd.; TAKASHIMA, Hajime; TSURUTA, Risa; YABUUCHI, Tetsuya; OKA, Yusuke; URABE, Hiroki; SUGA, Yoichiro; TAKAHASHI, Masato; UNEUCHI, Fumito; KOTSUBO, Hironori; SHOJI, Muneo; KAWAGUCHI, Yasuko Patent: EP2562155 A1, 2013 ; Location in patent: Paragraph 0222-0223 ;

~64%

tert-Butyl methyl(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)carbamate Structure

tert-Butyl meth...

CAS#:916587-44-5

Literature: Lin, Chen; Drueckhammer, Dale G. New Journal of Chemistry, 2006 , vol. 30, # 12 p. 1725 - 1730

~%

tert-Butyl methyl(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)carbamate Structure

tert-Butyl meth...

CAS#:916587-44-5

Literature: New Journal of Chemistry, , vol. 30, # 12 p. 1725 - 1730

~%

tert-Butyl methyl(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)carbamate Structure

tert-Butyl meth...

CAS#:916587-44-5

Literature: New Journal of Chemistry, , vol. 30, # 12 p. 1725 - 1730

 Synonyms

tert-butyl methyl(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)carbamate
4-(2-benzyl-3-phenyl-propenyl)-anisole
t-butyl-methyl(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)carbamate
methyl-(4-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)pnenyl)-carbamic acid tert-butyl ester
1,1-dimethylethyl methyl-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]carbamate
methyl-[4-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)phenyl]carbamic acid tert-butyl ester
3-Phenyl-1-(4-methoxy-phenyl)-2-benzyl-propen-(1)
4-Methoxy-1-(3-phenyl-2-benzyl-propenyl)-benzol
4-(2-Benzyl-3-phenyl-propenyl)-anisol
Benzene,1-methoxy-4-[3-phenyl-2-(phenylmethyl)-1-propenyl]
4-(N-tert-butoxycarbonyl-N-methylamino)phenylboronic acid pinacol ester
Methyl-[4-(3-phenyl-2-benzyl-propenyl)-phenyl]-aether
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