2-Allyl-5,5-dimethyl-1,3,2-dioxaborinane

Basic Information

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CAS Number

911482-75-2

Molecular Formula

C8H15BO2

Molecular Weight

154.02 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Basic Physical Properties

Density

0.9230

Refractive Index

1.4360-1.4400

SMILES

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B1(OCC(CO1)(C)C)CC=C

InChI

InChI=1S/C8H15BO2/c1-4-5-9-10-6-8(2,3)7-11-9/h4H,1,5-7H2,2-3H3

InChIKey

SBZNRMJWIVCYBF-UHFFFAOYSA-N

LogP

1.7335999999999998

Topological Polar Surface Area

18.46 Å²

Hydrogen Bond Donor/Acceptor

0 / 2

Complexity

135

Safety Information

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Hazard Statement

H226 Flammable liquid and vapor
Flammable liquids

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

Hazard Class

Class 3 Class 3

Synonyms & References

English

1,3,2-Dioxaborinane, 5,5-dimethyl-2-(2-propen-1-yl)-
2-Allyl-5,5-dimethyl-1,3,2-dioxaborinane (stabilized with Phenothiazine)
1,3,2-Dioxaborinane, 5,5-dimethyl-2-(2-propenyl)-
2-allyl-5,5-dimethyl-1,3,2-dioxaborinane
SY055525
1,3,2-Dioxaborinane, 5,5-dimethyl-2-(2-propenyl)- (9CI)
5,5-Dimethyl-2-(2-propen-1-yl)-1,3,2-dioxaborinane (ACI)
2-Allyl-5,5-dimethyl-1,3,2-dioxaborinane
5,5-dimethyl-2-prop-2-enyl-1,3,2-dioxaborinane
A2574
SCHEMBL13721770
CS-0173993
911482-75-2
allylboronic acid neopentyl glycol ester
T71449
5,5-DIMETHYL-2-(PROP-2-EN-1-YL)-1,3,2-DIOXABORINANE
MFCD27966263

MDL Number

MFCD27966263

FAQ

What regulatory guidelines apply to 2-Allyl-5,5-dimethyl-1,3,2-dioxaborinane (CAS: 911482-75-2)?

2-Allyl-5,5-dimethyl-1,3,2-dioxaborinane (CAS: 911482-75-2) falls under the scope of various regulatory guidelines such as GHS (Globally Harmonized System of Classification and Labeling of Chemicals) for hazardous substance classification. In Europe, it is also regulated under REACH (Registration, Evaluation, Authorization and Restriction of Chemicals). FDA and EPA may have specific requirements for its handling and disposal. It is advisable to consult the latest regulatory documents for detailed guidelines.

Are there alternatives to 2-Allyl-5,5-dimethyl-1,3,2-dioxaborinane (CAS: 911482-75-2) in synthesis?

Several alternatives to 2-Allyl-5,5-dimethyl-1,3,2-dioxaborinane (CAS: 911482-75-2) exist in synthesis, including 2-Allyl-1,3,2-dioxaborolane and 5,5-dimethyl-2-vinyl-1,3,2-dioxaborinane. These alternatives can be used as precursors in boronate pinacol coupling reactions. The choice of alternative depends on the specific reaction conditions and desired product.

What is the market or research trend for 2-Allyl-5,5-dimethyl-1,3,2-dioxaborinane (CAS: 911482-75-2)?

The research trend for 2-Allyl-5,5-dimethyl-1,3,2-dioxaborinane (CAS: 911482-75-2) is focused on its application in organic synthesis, particularly in coupling reactions and as a boronic acid precursor. Market demand is growing due to its utility in medicinal chemistry and materials science. Researchers are also exploring its use in novel chemical transformations and its potential in drug discovery.

How should waste containing 2-Allyl-5,5-dimethyl-1,3,2-dioxaborinane (CAS: 911482-75-2) be handled?

Waste containing 2-Allyl-5,5-dimethyl-1,3,2-dioxaborinane (CAS: 911482-75-2) should be collected in appropriate containers and stored properly to prevent environmental contamination. It should be disposed of through professional waste disposal services that comply with local regulations. Precautions include ensuring proper ventilation and using personal protective equipment. Incineration or other approved methods should be used for final disposal to minimize environmental impact.