3-(2-Methyl-4-pyrimidinyl)benzenesulfonyl chloride

Basic Information

View in Editor

CAS Number

465514-07-2

Molecular Formula

C11H9ClN2O2S

Molecular Weight

268.72 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

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

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Melting Point

174 °C

Boiling Point

428.063°C at 760 mmHg

Density

1.384

Flash Point

212.685°C

Refractive Index

1.588

SMILES

View in Editor

CC1=NC=CC(=N1)C2=CC(=CC=C2)S(=O)(=O)Cl

InChI

InChI=1S/C11H9ClN2O2S/c1-8-13-6-5-11(14-8)9-3-2-4-10(7-9)17(12,15)16/h2-7H,1H3

InChIKey

ZLLPUDLQNCNHFM-UHFFFAOYSA-N

LogP

2.3795200000000003

Topological Polar Surface Area

59.92 Å²

Hydrogen Bond Donor/Acceptor

0 / 4

Complexity

355

Safety Information

View Safety Information

Hazard Statement

Synonyms & References

English

BP-10991
A872253
J-510538
BCP34428
FT-0613571
3-(2-METHYL-4-PYRIMIDINYL)BENZENESULFONYL CHLORIDE
3-(2-Methyl-1,3-diazin-4-yl)benzenesulphonyl chloride
DTXSID80381566
MFCD03659718
CS-0314028
3-(2-methylpyrimidin-4-yl)benzene-1-sulfonyl chloride
SCHEMBL1020316
AS-31441
465514-07-2
3-(2-Methylpyrimidin-4-yl)-benzenesulfonyl chloride
3-(2-methyl-4-pyrimidinyl)benzenesulfonyl chloride, AldrichCPR
3-(2-methylpyrimidin-4-yl)benzenesulfonyl Chloride
3-(2-Methylpyrimidin-4-yl)benzenesulphonyl chloride
3-(2-Methylpyrimidin-4-yl)benzene-1-sulfonylchloride
4-[3-(Chlorosulphonyl)phenyl]-2-methylpyrimidine
AKOS007930889
3-(2-Methyl-4-pyrimidinyl)benzenesulfonyl chloride
3-(2-methylpyrimidin-4-yl)benzenesulfonyl chloride
3-(2-METHYLPYRIMIDIN-4-YL)BENZENESULPHONYL CHLORIDE
Benzenesulfonylchloride, 3-(2-methyl-4-pyrimidinyl)-

MDL Number

MFCD03659718

Customs Code

2933599090

FAQ

What are the physical and chemical properties of 3-(2-Methyl-4-pyrimidinyl)benzenesulfonyl chloride (CAS: 465514-07-2)?

3-(2-Methyl-4-pyrimidinyl)benzenesulfonyl chloride is a crystalline compound with a molecular weight of approximately 301.2 g/mol. It has a low solubility in water but is soluble in organic solvents like dichloromethane and ethanol. Chemically, it is reactive, particularly towards nucleophiles, and is used in various chemical reactions due to its electrophilic nature.

How is 3-(2-Methyl-4-pyrimidinyl)benzenesulfonyl chloride (CAS: 465514-07-2) typically synthesized?

3-(2-Methyl-4-pyrimidinyl)benzenesulfonyl chloride can be synthesized via a multi-step process involving the condensation of 2-methylpyrimidin-4-amine with benzenesulfonyl chloride. The reaction is typically conducted in the presence of a suitable base like triethylamine, and the product is isolated by recrystallization. This compound is often prepared using reagents and conditions that ensure high selectivity and good yield.

What industries use 3-(2-Methyl-4-pyrimidinyl)benzenesulfonyl chloride (CAS: 465514-07-2)?

3-(2-Methyl-4-pyrimidinyl)benzenesulfonyl chloride finds applications in the pharmaceutical industry for its role as an intermediate in drug synthesis. It is also used in the polymer industry for its potential in developing new polymer materials with specific properties. Additionally, it has applications in semiconductors and sensors due to its unique chemical structure.

What precautions should be taken when handling 3-(2-Methyl-4-pyrimidinyl)benzenesulfonyl chloride (CAS: 465514-07-2)?

When handling 3-(2-Methyl-4-pyrimidinyl)benzenesulfonyl chloride, it is essential to wear appropriate personal protective equipment (PPE), including gloves, goggles, and a lab coat. This compound should be used in a well-ventilated area or a fume hood to prevent inhalation. Spills should be cleaned up with caution, and the material safety data sheet (MSDS) should be consulted for specific cleanup procedures. Handling should be performed according to standard safety protocols to avoid skin and eye contact.