129541-42-0
5-bromo-4-chloro-3-indolyl caprylate
CAS: 129541-42-0
Molecular Formula: C16H19BrClNO2
129541-42-0 - Names and Identifiers
| Name | 5-bromo-4-chloro-3-indolyl caprylate |
| Synonyms | X-CAPRYLATE 5-BROMO-4-CHLOROINDOXYLCAPRYLATE 5-BROMO-4-CHLORO-3-INDOXYL CAPRYLATE 5-BROMO-4-CHLORO-3-INDOXYL OCTANOATE 5-BROMO-4-CHLORO-3-INDOLYL CAPRYLATE 5-bromo-4-chloro-3-indolyl caprylate 5-bromo-4-chloro-3-indolyl octanoate 5-Bromo-4-chloro-3-indolyl caprylate (X-Caprylate) |
| CAS | 129541-42-0 |
| InChI | InChI=1/C16H19BrClNO2/c1-2-3-4-5-6-7-14(20)21-13-10-19-12-9-8-11(17)16(18)15(12)13/h8-10,19H,2-7H2,1H3 |
| InChIKey | QTWMXGHFXBQNEJ-UHFFFAOYSA-N |
129541-42-0 - Physico-chemical Properties
| Molecular Formula | C16H19BrClNO2 |
| Molar Mass | 372.68 |
| Density | 1.397 |
| Melting Point | 58 - 60o C |
| Boling Point | 482.6±40.0 °C(Predicted) |
| Flash Point | 245.7°C |
| Solubility | DMSO (Slightly), Methanol (Slightly) |
| Vapor Presure | 1.8E-09mmHg at 25°C |
| Appearance | Solid |
| Color | White to Off-White |
| pKa | 13.70±0.30(Predicted) |
| Storage Condition | Sealed in dry,Store in freezer, under -20°C |
| Stability | Hygroscopic |
| Refractive Index | 1.592 |
| MDL | MFCD00083263 |
129541-42-0 - Risk and Safety
| Hazard Symbols | Xi - Irritant |
| Risk Codes | 36/37/38 - Irritating to eyes, respiratory system and skin. |
| Safety Description | 26 - In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. |
| WGK Germany | 3 |
129541-42-0 - Introduction
5-Bromo-4-chloro-3-indoxyl ester is an organic compound with the chemical formula C14H12BrClNO2. The following is a description of its nature, use, preparation and safety information:
Nature:
5-Bromo-4-chloro-3-indole octyl ester is an indole compound with bromine and chlorine functional groups. It is a colorless to pale yellow crystal or powder, soluble in organic solvents such as ethers and ketones, and slightly soluble in water. It has a high melting point and boiling point, and is relatively stable in air.
Use:
5-Bromo-4-chloro-3-indole octyl ester is widely used in organic synthesis. It can be used as a synthetic raw material for pharmaceutical and pesticide intermediates, and has antibacterial and insecticidal activities. In addition, it can also be used as a precursor of probes and dyes, and has certain applications in the field of chemical research and analysis.
Preparation Method:
The preparation method of 5-bromo-4-chloro-3-indole octyl ester can be obtained by esterification of 4-chloro-3-indole alcohol with bromoacetate under alkaline conditions. The specific synthesis steps can be optimized according to the specific experimental conditions.
Safety Information:
Safety needs to be paid attention to when using and handling 5-bromo-4-chloro-3-indole octyl ester. It may be irritating to the skin, eyes and mucous membranes. Direct contact should be avoided and appropriate personal protective equipment should be worn. In the process of operation to maintain good ventilation conditions, and to prevent the generation of dust. During storage and transportation, the container should be kept tightly closed and away from fire and oxidizing agents. When waste is disposed of, it should be disposed of in accordance with local regulations.
This is only a brief introduction to 5-bromo-4-chloro-3-indoxyl ester. The specific application and safe operation should be evaluated and implemented according to the actual situation.
Nature:
5-Bromo-4-chloro-3-indole octyl ester is an indole compound with bromine and chlorine functional groups. It is a colorless to pale yellow crystal or powder, soluble in organic solvents such as ethers and ketones, and slightly soluble in water. It has a high melting point and boiling point, and is relatively stable in air.
Use:
5-Bromo-4-chloro-3-indole octyl ester is widely used in organic synthesis. It can be used as a synthetic raw material for pharmaceutical and pesticide intermediates, and has antibacterial and insecticidal activities. In addition, it can also be used as a precursor of probes and dyes, and has certain applications in the field of chemical research and analysis.
Preparation Method:
The preparation method of 5-bromo-4-chloro-3-indole octyl ester can be obtained by esterification of 4-chloro-3-indole alcohol with bromoacetate under alkaline conditions. The specific synthesis steps can be optimized according to the specific experimental conditions.
Safety Information:
Safety needs to be paid attention to when using and handling 5-bromo-4-chloro-3-indole octyl ester. It may be irritating to the skin, eyes and mucous membranes. Direct contact should be avoided and appropriate personal protective equipment should be worn. In the process of operation to maintain good ventilation conditions, and to prevent the generation of dust. During storage and transportation, the container should be kept tightly closed and away from fire and oxidizing agents. When waste is disposed of, it should be disposed of in accordance with local regulations.
This is only a brief introduction to 5-bromo-4-chloro-3-indoxyl ester. The specific application and safe operation should be evaluated and implemented according to the actual situation.
Last Update：2024-04-09 20:52:54
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