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| CAS No.: | 913835-69-5 |
|---|---|
| Name: | BENZOFURAN-2,5-DIYLDIBORONIC ACID 98 |
| Molecular Structure: | |
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| Formula: | C8H8B2O5 |
| Molecular Weight: | 205.77 |
| Synonyms: | BENZOFURAN-2,5-DIYLDIBORONIC ACID 98;Benzofuran-2,5-yldiboronic acid;Benzofuran-2,5-yldiboronic acid 98%;Benzo[b]furan-2,5-diboronic acid, 98% |
| Density: | 1.46 g/cm3 |
| Melting Point: | 293-295 |
| Boiling Point: | 505.2 °C at 760 mmHg |
| Flash Point: | 259.4 °C |
| Hazard Symbols: | Xi |
| PSA: | 94.06000 |
| LogP: | -2.20760 |
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- Total:13 Page 1 of 1 1
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Specification
This chemical is called (5-Boronobenzofuran-2-yl)boronic acid, and its CAS registry number is 913835-69-5. With the molecular formula of C8H8B2O5, its molecular weight is 205.77. Additionally, its product categories are Blocks; Boronic Acids; Heterocycles.
Other characteristics of the (5-Boronobenzofuran-2-yl)boronic acid can be summarised as followings: (1)ACD/LogP: 1.41; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.34; (4)ACD/LogD (pH 7.4): 0.14; (5)#H bond acceptors: 5; (6)#H bond donors: 4; (7)#Freely Rotating Bonds: 6; (8)Polar Surface Area: 94.06 Å2; (9)Index of Refraction: 1.629; (10)Molar Refractivity: 49.86 cm3; (11)Molar Volume: 140.1 cm3; (12)Polarizability: 19.76×10-24cm3; (13)Surface Tension: 65 dyne/cm; (14)Density: 1.46 g/cm3; (15)Flash Point: 259.4 °C; (16)Enthalpy of Vaporization: 81.59 kJ/mol; (17)Boiling Point: 505.2 °C at 760 mmHg; (18)Vapour Pressure: 4.98E-11 mmHg at 25°C.
You can still convert the following datas into molecular structure:
1.SMILES: B(c1ccc2c(c1)cc(o2)B(O)O)(O)O
2.InChI: InChI=1/C8H8B2O5/c11-9(12)6-1-2-7-5(3-6)4-8(15-7)10(13)14/h1-4,11-14H
3.InChIKey: LCHGNXMXVDSVAR-UHFFFAOYAG