CHEMBRDG-BB 3018082
4-Allyl-5-[(3,4-dimethylphenoxy)methyl]-4H-1,2,4-triazole-3-thiol
CAS: 669740-12-9
Molecular Formula: C14H17N3OS
CHEMBRDG-BB 3018082 - Names and Identifiers
CHEMBRDG-BB 3018082 - Physico-chemical Properties
| Molecular Formula | C14H17N3OS |
| Molar Mass | 275.37 |
| Storage Condition | Room Temprature |
| Sensitive | Irritant |
| MDL | MFCD04054995 |
CHEMBRDG-BB 3018082 - Risk and Safety
| Hazard Symbols | Xi - Irritant |
| Hazard Class | IRRITANT |
CHEMBRDG-BB 3018082 - Introduction
4-Allyl-5-[(3,4-dimethylphenyl) methyl]-4H-1,2,4-triazole-3-thiol is an organically synthesized compound with the following properties:
Chemical formula: C14H16N2OS
Relative molecular mass: 268.36g/mol
Appearance: colorless solid
Melting point: 100-105°C
Boiling point: 343.7°C at 760 mmHg
Density: 1.23g/cm3
Solubility: Insoluble in water, soluble in organic solvents such as chloroform, dichloromethane and ethanol
The compound has a variety of uses, including:
1. pesticide intermediates: can be used as synthetic pesticides, herbicides and fungicides intermediates.
2. Drug research: It can be used as a precursor or intermediate for the synthesis of anticancer drugs.
3. Chemical research: can be used as a catalyst in organic synthesis reactions.
The compound can be synthesized by the following methods:
The synthesis method is complex, and the specific steps include:
1.3,4-dimethylaniline is reacted with methanol and phosphorus trichloride to obtain 3,4-dimethylphenoxymethylamine.
2. reacting 3,4-dimethylphenoxymethylamine with trimethylsilylammonium chloride to obtain 3,4-dimethylphenoxymethylmethylamine trimethylsilylquaternary ammonium salt.
3. The product obtained in step 2 is reacted with thiol to obtain the target product 4-Allyl-5-[(3,4-dimethylphenyl) methyl]-4H-1,2,4-triazole-3-thiol.
Regarding safety information, the compound has certain toxicity, and the following precautions should be observed:
1. avoid direct contact with skin and eyes, such as accidental contact should immediately rinse with plenty of water.
2. Avoid breathing gas, smoke, dust and steam.
3. Store in a cool, dry, well-ventilated place.
4. Use should wear appropriate protective gloves, glasses and breathing apparatus.
Please note that the above information is for reference only and the safety technical instructions provided by the chemical supplier should be consulted for specific use.
Chemical formula: C14H16N2OS
Relative molecular mass: 268.36g/mol
Appearance: colorless solid
Melting point: 100-105°C
Boiling point: 343.7°C at 760 mmHg
Density: 1.23g/cm3
Solubility: Insoluble in water, soluble in organic solvents such as chloroform, dichloromethane and ethanol
The compound has a variety of uses, including:
1. pesticide intermediates: can be used as synthetic pesticides, herbicides and fungicides intermediates.
2. Drug research: It can be used as a precursor or intermediate for the synthesis of anticancer drugs.
3. Chemical research: can be used as a catalyst in organic synthesis reactions.
The compound can be synthesized by the following methods:
The synthesis method is complex, and the specific steps include:
1.3,4-dimethylaniline is reacted with methanol and phosphorus trichloride to obtain 3,4-dimethylphenoxymethylamine.
2. reacting 3,4-dimethylphenoxymethylamine with trimethylsilylammonium chloride to obtain 3,4-dimethylphenoxymethylmethylamine trimethylsilylquaternary ammonium salt.
3. The product obtained in step 2 is reacted with thiol to obtain the target product 4-Allyl-5-[(3,4-dimethylphenyl) methyl]-4H-1,2,4-triazole-3-thiol.
Regarding safety information, the compound has certain toxicity, and the following precautions should be observed:
1. avoid direct contact with skin and eyes, such as accidental contact should immediately rinse with plenty of water.
2. Avoid breathing gas, smoke, dust and steam.
3. Store in a cool, dry, well-ventilated place.
4. Use should wear appropriate protective gloves, glasses and breathing apparatus.
Please note that the above information is for reference only and the safety technical instructions provided by the chemical supplier should be consulted for specific use.
Last Update：2024-04-09 20:02:46
