- Indole-7-boronic acid
- Indole-7-boronic acid pinacol ester
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Cas Database |
| Name |
Indole-7-boronic acid pinacol ester |
EINECS | N/A |
| CAS No. | 642494-37-9 | Density | 1.11 g/cm3 |
| PSA | 34.25000 | LogP | 2.46710 |
| Solubility | N/A | Melting Point |
94-96 °C |
| Formula | C14H18BNO2 | Boiling Point | 396 °C at 760 mmHg |
| Molecular Weight | 243.113 | Flash Point | 193.3 °C |
| Transport Information | N/A | Appearance | N/A |
| Safety | Risk Codes | N/A | |
| Molecular Structure |
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Hazard Symbols |
 Xi
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| Synonyms |
7-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)indole;7-(4,4,5,5-Tetramethyl-[1,3,2]dioxaborolan-2-yl)-1H-indole; |
Article Data | 27 |
Indole-7-boronic acid pinacol ester Specification
The Indole-7-boronic acid pinacol ester with cas registry number of 642494-37-9, belongs to the following product categories: (1)Boronic ester; (2)Indole; (3)Organoborons. Its systematic name is 7-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-indole. And its IUPAC name is 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3H-indole. This chemical should keep cold.
Physical properties about this chemical are: (1)#H bond acceptors: 3; (2)#H bond donors: 1; (3)#Freely Rotating Bonds: 1; (4)Polar Surface Area: 23.39 Å2; (5)Index of Refraction: 1.562; (6)Molar Refractivity: 70.93 cm3; (7)Molar Volume: 218.5 cm3; (8)Polarizability: 28.12×10-24cm3; (9)Surface Tension: 39.5 dyne/cm; (10)Enthalpy of Vaporization: 62.1 kJ/mol; (11)Vapour Pressure: 4.03E-06 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES:O1B(OC(C)(C)C1(C)C)c3cccc2ccnc23;
(2)InChI:InChI=1/C14H18BNO2/c1-13(2)14(3,4)18-15(17-13)11-7-5-6-10-8-9-16-12(10)11/h5-9,16H,1-4H3;
(3)InChIKey:QAXZRSICOHKXML-UHFFFAOYAJ;
(4)Std. InChI:InChI=1S/C14H18BNO2/c1-13(2)14(3,4)18-15(17-13)11-7-5-6-10-8-9-16-12(10)11/h5-9,16H,1-4H3;
(5)Std. InChIKey:QAXZRSICOHKXML-UHFFFAOYSA-N
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