methyl 3-(isothiocyanatomethyl)benzoate
Methyl 3-(isothiocyanatomethyl)benzoate
CAS: 448948-73-0
Molecular Formula: C10H9NO2S
methyl 3-(isothiocyanatomethyl)benzoate - Names and Identifiers
| Name | Methyl 3-(isothiocyanatomethyl)benzoate |
| Synonyms | methyl 3-(isothiocyanatomethyl)benzoate Methyl 3-(isothiocyanatomethyl)benzoate benzoic acid, 3-(isothiocyanatomethyl)-, methyl ester |
| CAS | 448948-73-0 |
methyl 3-(isothiocyanatomethyl)benzoate - Physico-chemical Properties
| Molecular Formula | C10H9NO2S |
| Molar Mass | 207.25 |
| Storage Condition | Room Temprature |
| Sensitive | Irritant |
| MDL | MFCD12198085 |
methyl 3-(isothiocyanatomethyl)benzoate - Risk and Safety
| Hazard Class | IRRITANT |
methyl 3-(isothiocyanatomethyl)benzoate - Introduction
Methyl 3-(isothiocyanatomethyl)benzoate is an organic compound with the chemical formula C10H9NO2S.
The compound is a white crystalline solid and is soluble in some organic solvents, such as chloroform and dichloromethane. It has a melting point of about 67-68°C and a boiling point of about 310-315°C.
The Methyl 3-(isothiocyanatomethyl)benzoate has some important uses. It can be used as an important intermediate in organic synthesis for the synthesis of other compounds such as amino acids and peptides. In addition, the compounds can also be used as starting materials for insecticides and fungicides.
The method for preparing Methyl 3-(isothiocyanatomethyl)benzoate is usually carried out by the cyanation reaction of methyl 3-(chloromethyl) benzoic acid. First, under alkaline conditions, chloromethylbenzoic acid reacts with ammonia to produce chloromethylbenzoylammonia, and then by adding sodium thiosulfate and reacting with methanol under alkaline conditions, the desired product is obtained.
Regarding safety information, the specific hazards and safety measures benzoate by Methyl 3-(isothiocyanatomethyl) need to be evaluated according to local safety regulations and Material Safety Data Sheets (MSDS). In general, chemicals should be used in an appropriate laboratory environment and in accordance with relevant safety practices and precautions, such as wearing protective gloves, goggles and protective clothing. For specific safety information, please refer to the relevant safety data sheet for the compound.
The compound is a white crystalline solid and is soluble in some organic solvents, such as chloroform and dichloromethane. It has a melting point of about 67-68°C and a boiling point of about 310-315°C.
The Methyl 3-(isothiocyanatomethyl)benzoate has some important uses. It can be used as an important intermediate in organic synthesis for the synthesis of other compounds such as amino acids and peptides. In addition, the compounds can also be used as starting materials for insecticides and fungicides.
The method for preparing Methyl 3-(isothiocyanatomethyl)benzoate is usually carried out by the cyanation reaction of methyl 3-(chloromethyl) benzoic acid. First, under alkaline conditions, chloromethylbenzoic acid reacts with ammonia to produce chloromethylbenzoylammonia, and then by adding sodium thiosulfate and reacting with methanol under alkaline conditions, the desired product is obtained.
Regarding safety information, the specific hazards and safety measures benzoate by Methyl 3-(isothiocyanatomethyl) need to be evaluated according to local safety regulations and Material Safety Data Sheets (MSDS). In general, chemicals should be used in an appropriate laboratory environment and in accordance with relevant safety practices and precautions, such as wearing protective gloves, goggles and protective clothing. For specific safety information, please refer to the relevant safety data sheet for the compound.
Last Update：2024-04-10 22:29:15
