135812-52-1

Basic information

• Product Name: 1-methylethyl 2-chloro-5-[(phenylcarbonothioyl)amino]benzoate
• Synonyms: benzoic acid, 2-chloro-5-[(phenylthioxomethyl)amino]-, 1-methylethyl ester; propan-2-yl 2-chloro-5-[(phenylcarbothioyl)amino]benzoate
• CAS NO: 135812-52-1
• Molecular Formula: C₁₇H₁₆ClNO₂S
• Molecular Weight: 333.8324
• Mol File: 135812-52-1.mol
• Article Data: 0

Chemical Properties

• Boiling Point: 444°C at 760 mmHg
• Flash Point: 222.3°C
• Density: 1.286g/cm³
• Vapor Pressure: 4.42E-08mmHg at 25°C
• Refractive Index: 1.644
• CAS DataBase Reference: 1-methylethyl 2-chloro-5-[(phenylcarbonothioyl)amino]benzoate(CAS DataBase Reference)
• NIST Chemistry Reference: 1-methylethyl 2-chloro-5-[(phenylcarbonothioyl)amino]benzoate(135812-52-1)
• EPA Substance Registry System: 1-methylethyl 2-chloro-5-[(phenylcarbonothioyl)amino]benzoate(135812-52-1)

Safety Data

• Hazardous Substances Data: 135812-52-1(Hazardous Substances Data)

Usage

Explanation

The compound consists of 16 carbon atoms, 15 hydrogen atoms, 1 chlorine atom, 1 nitrogen atom, and 1 sulfur atom.
2. Ester derivative

Explanation

It is derived from 2-chloro-5-[(phenylcarbonothioyl)amino]benzoic acid by replacing the carboxylic acid group (-COOH) with an ester group (-COOR).
3. Chlorine atom

Explanation

The compound contains one chlorine atom as part of its structure, which can influence its reactivity, stability, and physical properties.
4. Phenylcarbonothioylamino group

Explanation

This functional group (-NH-C(=S)-C6H5) is present in the compound, which can contribute to its chemical reactivity and potential applications.
5. Potential applications

Explanation

The compound has potential uses in various fields, such as pharmaceuticals, agriculture, and material science, due to its unique structure and properties.
6. Intermediate in synthesis

Explanation

It may be used as an intermediate in the synthesis of other chemical compounds, which can lead to the development of new products and technologies.
7. Safety measures and regulations

Explanation

Proper handling and storage of the compound are essential to prevent any potential harm to human health or the environment, as it may have hazardous properties.
8. Further research and testing

Explanation

Additional studies and tests may be required to fully understand the properties and potential uses of this chemical compound, ensuring its safe and effective application in various industries.