3-(phenylcarbonyl)benzoate
3-Benzoylbenzoic acid
CAS: 579-18-0
Molecular Formula: C14H10O3
3-(phenylcarbonyl)benzoate - Names and Identifiers
| Name | 3-Benzoylbenzoic acid |
| Synonyms | 3-benzoyl-benzoicaci 3-Benzoylbenzoic acid 3-carboxybenzophenone 3-BENZOYLBENZOIC ACID m-Benzoyl benzoic acid M-BENZOYL BENZOIC ACID 3-BENZOYL-BENZONIC ACID META-BENZOYLBENZOICACID benzoic acid, 3-benzoyl- 3-(phenylcarbonyl)benzoate BENZOPHENONE-3-CARBOXYLIC ACID |
| CAS | 579-18-0 |
| EINECS | 621-014-9 |
| InChI | InChI=1/C14H10O3/c15-13(10-5-2-1-3-6-10)11-7-4-8-12(9-11)14(16)17/h1-9H,(H,16,17)/p-1 |
| InChIKey | AXJXRLHTQQONQR-UHFFFAOYSA-N |
3-(phenylcarbonyl)benzoate - Physico-chemical Properties
| Molecular Formula | C14H10O3 |
| Molar Mass | 226.23 |
| Density | 1.2022 (rough estimate) |
| Melting Point | 164-166 °C (lit.) |
| Boling Point | 327.84°C (rough estimate) |
| Flash Point | 227.3°C |
| Water Solubility | Insoluble in water. |
| Vapor Presure | 4.04E-08mmHg at 25°C |
| Appearance | Powder |
| Color | White to light beige |
| BRN | 2212366 |
| pKa | 3.86±0.10(Predicted) |
| Storage Condition | Inert atmosphere,Room Temperature |
| Refractive Index | 1.5767 (estimate) |
| MDL | MFCD00002518 |
3-(phenylcarbonyl)benzoate - Risk and Safety
| Hazard Symbols | Xi - Irritant |
| Risk Codes | 36/37/38 - Irritating to eyes, respiratory system and skin. |
| Safety Description | S26 - In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. S37/39 - Wear suitable gloves and eye/face protection |
| WGK Germany | 3 |
| HS Code | 29183000 |
3-(phenylcarbonyl)benzoate - Introduction
3-Benzoylbenzoic acid, chemical formula C14H10O3, is an organic compound. The following is a description of its nature, use, preparation and safety information:
Nature:
-Appearance: White crystalline solid.
-Melting point: 218-221 degrees Celsius.
-Solubility: Can be dissolved in ethanol, dimethylformamide (DMF), chloroform and other organic solvents, relatively insoluble in water.
Use:
- 3-Benzoylbenzoic acid is commonly used as a reagent and intermediate in organic synthesis reactions.
-It can be used to synthesize other organic compounds, such as drugs, dyes, polymer compounds, etc.
- 3-Benzoylbenzoic acid can also be used as a precursor for heterocyclic dyes.
Preparation Method:
- 3-Benzoylbenzoic acid can be synthesized by acid-catalyzed benzoylation.
-Usually benzoyl chloride and benzoic acid are reacted at temperature in the presence of a base to generate 3-Benzoylbenzoic acid.
Safety Information:
- 3-Benzoylbenzoic acid is less harmful to the human body under normal operating conditions.
-But it is still necessary to avoid direct contact with skin and eyes to avoid irritation and allergic reactions.
-Good laboratory practices such as wearing gloves, safety glasses and protective clothing should be followed during handling.
-It should be stored properly to avoid contact with incompatible substances such as oxidants and avoid sources of fire.
-In use, attention should be paid to environmental protection and avoid discharge into water or soil.
Nature:
-Appearance: White crystalline solid.
-Melting point: 218-221 degrees Celsius.
-Solubility: Can be dissolved in ethanol, dimethylformamide (DMF), chloroform and other organic solvents, relatively insoluble in water.
Use:
- 3-Benzoylbenzoic acid is commonly used as a reagent and intermediate in organic synthesis reactions.
-It can be used to synthesize other organic compounds, such as drugs, dyes, polymer compounds, etc.
- 3-Benzoylbenzoic acid can also be used as a precursor for heterocyclic dyes.
Preparation Method:
- 3-Benzoylbenzoic acid can be synthesized by acid-catalyzed benzoylation.
-Usually benzoyl chloride and benzoic acid are reacted at temperature in the presence of a base to generate 3-Benzoylbenzoic acid.
Safety Information:
- 3-Benzoylbenzoic acid is less harmful to the human body under normal operating conditions.
-But it is still necessary to avoid direct contact with skin and eyes to avoid irritation and allergic reactions.
-Good laboratory practices such as wearing gloves, safety glasses and protective clothing should be followed during handling.
-It should be stored properly to avoid contact with incompatible substances such as oxidants and avoid sources of fire.
-In use, attention should be paid to environmental protection and avoid discharge into water or soil.
Last Update：2024-04-09 02:00:46
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