6-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)isoquinoline

Basic Information

View in Editor

CAS Number

675576-26-8

Molecular Formula

C15H18BNO2

Molecular Weight

255.13 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Basic Physical Properties

Melting Point

179-184 °C

Density

1.10±0.1 g/cm3 (20 ºC 760 Torr)

SMILES

View in Editor

B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)C=NC=C3

InChI

InChI=1S/C15H18BNO2/c1-14(2)15(3,4)19-16(18-14)13-6-5-12-10-17-8-7-11(12)9-13/h5-10H,1-4H3

InChIKey

LFALMDZWCMSBFO-UHFFFAOYSA-N

LogP

2.5340000000000007

Topological Polar Surface Area

31.35 Å²

Hydrogen Bond Donor/Acceptor

0 / 3

Complexity

329

Safety Information

View Safety Information

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

675576-26-8
DTXSID80582879
MFCD11227091
6-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)ISOQUINOLINE
EN300-1425735
6-(TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)ISOQUINOLINE
SCHEMBL2232278
FT-0603968
6-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)isoquinoline (>85%)
SB38244
6-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl) isoquinoline
6-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)-isoquinoline
Isoquinoline-6-boronic acid pinacol ester
LFALMDZWCMSBFO-UHFFFAOYSA-N
Isoquinoline-6-boronic acid pinacol ester, 95%
AKOS022173471
A9049
Z2044761365
6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)isoquinoline

MDL Number

MFCD11227091

Customs Code

2934999090

FAQ

What is 6-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)isoquinoline (CAS: 675576-26-8)?

6-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)isoquinoline (CAS: 675576-26-8) is an organic compound with the molecular formula C17H21BN2O2. It is characterized by its isoquinoline core and a tetramethyl-1,3,2-dioxaborolane substituent. This compound is known for its potential applications in pharmaceuticals and organic synthesis.

What are the main uses of 6-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)isoquinoline (CAS: 675576-26-8)?

6-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)isoquinoline (CAS: 675576-26-8) is primarily used in the pharmaceutical industry as a key intermediate in the synthesis of various drug candidates. It is also utilized in organic chemistry for its reactivity with boron-containing reagents.

Is 6-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)isoquinoline (CAS: 675576-26-8) safe?

6-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)isoquinoline (CAS: 675576-26-8) is generally considered safe for handling under normal laboratory conditions. However, it is important to follow proper safety protocols, including wearing appropriate personal protective equipment (PPE) such as gloves and goggles. Avoid contact with eyes and skin, and ensure proper ventilation during use.

How should 6-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)isoquinoline (CAS: 675576-26-8) be stored?

6-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)isoquinoline (CAS: 675576-26-8) should be stored in a cool, dry place away from direct sunlight and heat sources. It should be kept in a tightly closed container to prevent degradation. It is advisable to store the compound at temperatures below 25°C to maintain its stability.