(3-Formyl-5-methylphenyl)boronic acid

Basic Information

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CAS Number

870777-33-6

Molecular Formula

C8H9BO3

Molecular Weight

163.97 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Aldehydes

Fine Chemicals Dyes and Pigments Organic Dyes

Basic Physical Properties

SMILES

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CC1=CC(=CC(C=O)=C1)B(O)O

InChI

InChI=1S/C8H9BO3/c1-6-2-7(5-10)4-8(3-6)9(11)12/h2-5,11-12H,1H3

InChIKey

IDXLUNCVVBZUEN-UHFFFAOYSA-N

LogP

-0.51268

Topological Polar Surface Area

57.53 Å²

Hydrogen Bond Donor/Acceptor

2 / 3

Complexity

160

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

(3-Formyl-5-methylphenyl)boronic acid
3-FORMYL-5-METHYLPHENYLBORONIC ACID
3-Fornyl-5-methylphenylboronic acid
Boronic acid,B-(3-formyl-5-methylphenyl)-
IDXLUNCVVBZUEN-UHFFFAOYSA-N
FCH1122944
TRA0100264
AM85133
AB44850
(3-Formyl-5-methyl-phenyl)boronic acid
OR350181
BC001785
ST2407982
AX8217996
X1405
Boronic acid, B-(3-formyl
(3-formyl-5-methylphenyl)boronic acid

MDL Number

MFCD08276762

Customs Code

2931900090

FAQ

What is (3-Formyl-5-methylphenyl)boronic acid (CAS: 870777-33-6)?

(3-Formyl-5-methylphenyl)boronic acid is a chemical compound with the CAS number 870777-33-6. It is a derivative of phenylboronic acid with a formyl group attached to the 3-position and a methyl group attached to the 5-position. This compound has a molecular formula of C10H10O3B and is often used in organic synthesis and pharmaceutical research.

What are the main uses of (3-Formyl-5-methylphenyl)boronic acid (CAS: 870777-33-6)?

(3-Formyl-5-methylphenyl)boronic acid (CAS: 870777-33-6) is primarily used in organic synthesis, particularly as a key intermediate in the preparation of various organic compounds. It also finds applications in pharmaceutical research for developing new drugs and as a reagent in medicinal chemistry.

Is (3-Formyl-5-methylphenyl)boronic acid (CAS: 870777-33-6) safe?

(3-Formyl-5-methylphenyl)boronic acid (CAS: 870777-33-6) is generally considered safe when handled with appropriate precautions. However, it should be used in a well-ventilated area and with proper personal protective equipment (PPE) such as gloves and goggles. It is important to follow safety guidelines and adhere to proper disposal methods to ensure safety.

How should (3-Formyl-5-methylphenyl)boronic acid (CAS: 870777-33-6) be stored?

(3-Formyl-5-methylphenyl)boronic acid (CAS: 870777-33-6) should be stored in a cool, dry place away from direct sunlight and heat sources to maintain its stability. It should be kept in a tightly sealed container to prevent moisture absorption. Proper storage conditions are crucial to ensure the compound's quality and safety.