ChemicalBook > CAS DataBase List > 2-Benzoylbenzoic acid
2-Benzoylbenzoic acid
2-Benzoylbenzoic acid
- CAS No.85-52-9
- Chemical Name:2-Benzoylbenzoic acid
- CBNumber:CB4741530
- Molecular Formula:C14H10O3
- Formula Weight:226.23
- MOL File:85-52-9.mol
2-Benzoylbenzoic acid Property
- Melting point 126-129 °C (lit.)
- Boiling point 257-265 °C (lit.)
- Density 1.2022 (rough estimate)
- refractive index 1.5767 (estimate)
- Flash point 257°C
- storage temp. Sealed in dry,Room Temperature
- solubility Chloroform (Slightly), Methanol (Slightly)
- form Crystalline Powder
- pka pK1: 3.54 (25°C)
- color Almost white to slightly beige
- Water Solubility 284mg/L at 20℃
- BRN 1107841
- InChIKey FGTYTUFKXYPTML-UHFFFAOYSA-N
- LogP 1.4 at 35℃
- CAS DataBase Reference 85-52-9(CAS DataBase Reference)
- EWG's Food Scores 1
- FDA UNII 1N20Y812XW
- NIST Chemistry Reference Benzoic acid, 2-benzoyl-(85-52-9)
- EPA Substance Registry System Benzoic acid, 2-benzoyl- (85-52-9)
- UNSPSC Code 12352100
- NACRES NA.22
Safety
- Hazard Codes :Xi
- Risk Statements :36/37/38
- Safety Statements :26-36-37/39
- WGK Germany :2
- RTECS :DG3600000
- TSCA :Yes
- HS Code :29183000
- Hazardous Substances Data :85-52-9(Hazardous Substances Data)
- Toxicity :LD50 orl-rat: 4600 mg/kg GTPZAB 15(11),52,71
-
NFPA 704:
0 2 0
-
Symbol(GHS)
- Signal wordWarning
- Hazard statements H315-H319-H335
- Precautionary statements P280g-P305+P351+P338-P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313
2-Benzoylbenzoic acid Price
More Price(5)
- Brand: Sigma-Aldrich(India)
- Product number: B12385
- Product name : 2-Benzoylbenzoic acid
- Purity: 98%
- Packaging: 25G
- Price: ₹2619.65
- Updated: 2022/06/14
- Buy: Buy
- Brand: Sigma-Aldrich(India)
- Product number: B12385
- Product name : 2-Benzoylbenzoic acid
- Purity: 98%
- Packaging: 500G
- Price: ₹5304.25
- Updated: 2022/06/14
- Buy: Buy
- Brand: TCI Chemicals (India)
- Product number: B0103
- Product name : 2-Benzoylbenzoic Acid
- Purity: min. 98.0 %
- Packaging: 25G
- Price: ₹1900
- Updated: 2022/05/26
- Buy: Buy
- Brand: ottokemi
- Product number: B 2334
- Product name : 2-Benzoylbenzoic acid
- Purity: 98%
- Packaging: 25gm
- Price: ₹1899
- Updated: 2022/05/26
- Buy: Buy
- Brand: ottokemi
- Product number: B 2334
- Product name : 2-Benzoylbenzoic acid
- Purity: 98%
- Packaging: 500gm
- Price: ₹13059
- Updated: 2022/05/26
- Buy: Buy
2-Benzoylbenzoic acid Chemical Properties,Usage,Production
- Synthesis In the presence of aluminum trichloride, phthalic anhydride and benzene are condensed and obtained by hydrolysis. The hydrochloric acid gas by-product in the reaction should preferably be absorbed into dilute hydrochloric acid for subsequent use. The industrial benzoylbenzoic acid is white to beige powder, the purity is above 97%, and the initial melting point of the dry product is ≥126.0%.
- Chemical Properties ALMOST WHITE TO SLIGHTLY BEIGE CRYSTALLINE POWDER
- Uses 2-Benzoylbenzoic Acid is a reagent that is used in the synthesis of BzATP Triethylammonium Salt, which is a selective P2X purinergic agonist. It is more potent than ATP at homodimeric P2X7 receptors.
-
Synthesis Reference(s)
Journal of the American Chemical Society, 70, p. 2758, 1948 DOI: 10.1021/ja01188a035
The Journal of Organic Chemistry, 39, p. 2051, 1974 DOI: 10.1021/jo00928a016 - Flammability and Explosibility Not classified
- Safety Profile Moderately toxic by ingestion.When heated to decomposition it emits acrid smoke andirritating vapors.
- Purification Methods Recrystallise the acid from *C6H6 or cyclohexane, but it is best recrystallised by dissolving in a small volume of hot toluene and then adding just enough pet ether to cause turbidity, and cool. Dry it in a low vacuum at 80o. It can be sublimed at 230-240o/0.3mm [Bray et al. J Chem Soc 265 1957]. The S-benzylisothiuronium salt has m 177-178o (from EtOH). [Lewenz & Serijan J Am Chem Soc 75 4087 1953, Beilstein 10 H 747, 10 IV 2977.]
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Raw materials
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