CAS 64113-84-4

2-fluoro-5-methylbenzonitrile

Description:

2-Fluoro-5-methylbenzonitrile is an aromatic compound characterized by the presence of a fluorine atom and a nitrile group attached to a benzene ring. Its molecular structure features a methyl group at the 5-position and a fluorine substituent at the 2-position of the benzene ring, contributing to its unique chemical properties. This compound is typically a colorless to pale yellow liquid or solid, depending on its physical state at room temperature. It is known for its moderate polarity due to the presence of the nitrile group, which can participate in hydrogen bonding and dipole interactions. The fluorine atom enhances the compound's reactivity and can influence its solubility in various solvents. 2-Fluoro-5-methylbenzonitrile is often utilized in organic synthesis and may serve as an intermediate in the production of pharmaceuticals or agrochemicals. Safety data indicates that it should be handled with care, as it may pose health risks if inhaled or ingested. Proper safety measures, including the use of personal protective equipment, are recommended when working with this substance.

Formula: C₈H₆FN

InChI: InChI=1/C8H6FN/c1-6-2-3-8(9)7(4-6)5-10/h2-4H,1H3

SMILES: Cc1ccc(c(c1)C#N)F

Synonyms:

• 3-Cyano-4-Fluorotoluene

2-Fluoro-5-methylbenzonitrile

CAS: 64113-84-4

Formula: C₈H₆FN

Purity: >98.0%(GC)

Color and Shape: White to Orange to Green powder to crystal

Molecular weight: 135.14

Ref: 3B-F0573

2-Fluoro-5-methylbenzonitrile, 99%

CAS: 64113-84-4

This Thermo Scientific Chemicals brand product was originally part of the Alfa Aesar product portfolio. Some documentation and label information may refer to the legacy brand. The original Alfa Aesar product / item code or SKU reference has not changed as a part of the brand transition to Thermo Sci

Formula: C₈H₆FN

Purity: 99%

Color and Shape: White, Crystals or powder or crystalline powder

Molecular weight: 135.14

Ref: 02-H26166

2-Fluoro-5-Methylbenzonitrile

CAS: 64113-84-4

Formula: C₈H₆FN

Purity: 98%

Color and Shape: Solid

Molecular weight: 135.1383

Ref: IN-DA003HAE

2-Fluoro-5-methylbenzonitrile

CAS: 64113-84-4

2-Fluoro-5-methylbenzonitrile

Formula: C₈H₆FN

Purity: 98%

Color and Shape: Solid

Molecular weight: 135.14g/mol

Ref: 54-PC8655

2-Fluoro-5-methylbenzonitrile

CAS: 64113-84-4

2-Fluoro-5-methylbenzonitrile (2FMBC) is a molecule that has a molecular weight of 153.22 g/mol and a melting point of -30°C. It also has a boiling point of 190°C at 14 mmHg, and it is soluble in ethanol, ether, acetone, benzene, chloroform, carbon disulfide, and nitrobenzene. 2FMBC can be found in the vibrational spectrum from 400 to 700 nm with a maximum absorption frequency of 724 nm. The infrared spectrum for 2FMBC ranges from 700 cm-1 to 3200 cm-1. The molecular orbital theory predicts that the energy levels for this molecule are symmetrical and unsymmetrical. It has been shown by x-ray data that 2FMBC's dipole moment is 0 D.

Formula: C₈H₆FN

Purity: Min. 95%

Color and Shape: Powder

Molecular weight: 135.14 g/mol

Ref: 3D-FF64150

2-Fluoro-5-methylbenzonitrile

CAS: 64113-84-4

Formula: C₈H₆FN

Purity: 97%

Color and Shape: Solid

Molecular weight: 135.141

Ref: 10-F010683