4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)isoxazole

Basic Information

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CAS Number

928664-98-6

Molecular Formula

C9H14BNO3

Molecular Weight

195.03 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Basic Physical Properties

Melting Point

110-115 °C

SMILES

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B1(OC(C(O1)(C)C)(C)C)C2=CON=C2

InChI

InChI=1S/C9H14BNO3/c1-8(2)9(3,4)14-10(13-8)7-5-11-12-6-7/h5-6H,1-4H3

InChIKey

LXCICYRNWIGDQA-UHFFFAOYSA-N

LogP

0.9737999999999999

Topological Polar Surface Area

44.49 Å²

Hydrogen Bond Donor/Acceptor

0 / 4

Complexity

216

Safety Information

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Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

H312 Harmful in contact with skin
Acute toxicity, dermal

H332 Harmful if inhaled
Acute toxicity, inhalation

Synonyms & References

English

4-Isoxazoleboronic acid pinacol ester
4-(4,4,5,5-tetraMethyl-1,3,2-dioxaborolan-2-yl)isoxazole
3-Hydroxy-2,3-diMethylbutan-2-yl hydrogen 1,2-oxazol-4-ylboronate
Isoxazole-4-boronic acid pinacol ester
4-(4,4,5,5-Tetramethyl-[1,3,2]dioxaborolan-2-yl)-isoxazole
4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,2-oxazole
4-isooxazolylboronic acid pinacol ester
Isoxazole, 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-
LXCICYRNWIGDQA-UHFFFAOYSA-N
EOS147
AMBA00007
FCH853063
AB25740
AM85030
4-isoo
4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)isoxazole (ACI)
4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-1,2-oxazole
Isoxazol-4-ylboronic acid pinacol ester
4-(tetramethyl-1,3,2-dioxaborolan-2-yl)-1,2-oxazole
MFCD06657891
928664-98-6
CS-W001065
SY025655
4-(TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)-1,2-OXAZOLE
EN300-212573
SCHEMBL142345
Z1198169385
4-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)-isoxazole
4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)isoxazole
4-Isoxazoleboronic acid, pinacol ester
AKOS006293858

MDL Number

MFCD06657891

Customs Code

2934999090

FAQ

What regulatory guidelines apply to 4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)isoxazole (CAS: 928664-98-6)?

The compound 4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)isoxazole (CAS: 928664-98-6) is subject to various regulatory guidelines, including REACH for European manufacturers and importers. It is also governed by GHS classification for hazardous chemicals. The FDA and EPA may also have specific regulations for its use in pharmaceuticals and environmental applications, respectively.

Are there alternatives to 4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)isoxazole (CAS: 928664-98-6) in synthesis?

In synthesis, alternatives to 4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)isoxazole (CAS: 928664-98-6) include other isoxazoles with different substituents, such as 4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-5-methylisoxazole. Other common alternative reagents in boronate ester formation include triphenylphosphine and sodium hydride.

What is the market or research trend for 4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)isoxazole (CAS: 928664-98-6)?

The market for 4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)isoxazole (CAS: 928664-98-6) is driven by its use in organic synthesis and medicinal chemistry. Research trends are focusing on its application in catalysis and the development of new drug candidates. Market trends indicate increased demand due to its role in sustainable chemical processes.

How should waste containing 4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)isoxazole (CAS: 928664-98-6) be handled?

Waste containing 4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)isoxazole (CAS: 928664-98-6) should be collected in appropriate containers and disposed of through professional waste disposal services. Incineration or other suitable methods must be used to ensure compliance with environmental regulations. Protective measures should be taken to prevent environmental contamination.