2-(4-Methoxy-3-nitrophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

Basic Information

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CAS Number

554411-20-0

Molecular Formula

C13H18BNO5

Molecular Weight

279.1 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

Boiling Point

393.7°C at 760 mmHg

Density

1.16±0.1 g/cm3 (20 ºC 760 Torr),

Flash Point

191.9°C

Refractive Index

1.513

SMILES

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B1(OC(C(O1)(C)C)(C)C)C2=CC(=C(C=C2)OC)[N+](=O)[O-]

InChI

InChI=1S/C13H18BNO5/c1-12(2)13(3,4)20-14(19-12)9-6-7-11(18-5)10(8-9)15(16)17/h6-8H,1-5H3

InChIKey

RHBKXETXNLZMEX-UHFFFAOYSA-N

LogP

2.42580

Complexity

365

Safety Information

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Hazard Statement

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Synonyms & References

English

C13H18BNO5
SCHEMBL4771663
2-(4-methoxy-3-nitro-phenyl)-4,4,5,5-tetramethyl-[1,3,2] dioxaborolane
2-(4-methoxy-3-nitro-phenyl)-4,4,5,5-tetramethyl-[1,3,2]dioxaborolane
1,3,2-DIOXABOROLANE, 2-(4-METHOXY-3-NITROPHENYL)-4,4,5,5-TETRAMETHYL-
AM90112
FT-0644786
RHBKXETXNLZMEX-UHFFFAOYSA-N
4-methoxy-3-nitrophenylboronic acid pinacol ester, AldrichCPR
4-methoxy-3-nitro-phenylboronic acid pinacol ester
4-Methoxy-3-nitrophenylboronic acid, pinacol ester, AldrichCPR
AS-2925
MFCD06795663
AB29205
DTXSID80590393
E90017
554411-20-0
4-Methoxy-3-nitrophenylboronic acid pinacol ester
A848966
CS-0175554
2-(4-Methoxy-3-nitrophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
4-Methoxy-3-nitrophenylboronic acid, pinacol ester
AKOS015960125
1,3,2-Dioxaborolane,2-(4-methoxy-3-nitrophenyl)-4,4,5,5-tetramethyl-
4-Methoxy-3-Nitrophenylboronic Acid Pinacol Ester

MDL Number

MFCD06795663

Customs Code

2934999090

FAQ

What regulatory guidelines apply to 2-(4-Methoxy-3-nitrophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane (CAS: 554411-20-0)?

This compound must comply with the Globally Harmonized System of Classification and Labeling of Chemicals (GHS), REACH regulations, and may also be subject to FDA and EPA requirements for specific applications. It is advisable to consult relevant regulatory bodies for detailed guidelines.

Are there alternatives to 2-(4-Methoxy-3-nitrophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane (CAS: 554411-20-0) in synthesis?

Several alternatives can be used in synthesis, such as 2-(4-ethoxy-3-nitrophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane or 2-(4-fluoro-3-nitrophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane. These analogs may offer similar functionality with different reactivity profiles.

What is the market or research trend for 2-(4-Methoxy-3-nitrophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane (CAS: 554411-20-0)?

The market for this compound is growing due to its applications in pharmaceuticals and organic synthesis. Research trends are focusing on developing new synthetic methods and exploring its potential in medicinal chemistry.

How should waste containing 2-(4-Methoxy-3-nitrophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane (CAS: 554411-20-0) be handled?

Waste containing this compound should be collected in a closed container and disposed of by incineration or professional waste disposal services. Proper environmental protection measures, such as neutralization and containment, should be taken during handling to prevent environmental contamination.