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| CAS No.: | 452972-09-7 |
|---|---|
| Name: | 5-Bromopyridine-3-boronic acid |
| Article Data: | 4 |
| Molecular Structure: | |
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|
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| Formula: | C5H5BBrNO2 |
| Molecular Weight: | 201.815 |
| Synonyms: | Boronicacid, (5-bromo-3-pyridinyl)- (9CI);(3-Bromopyridin-5-yl)boronic acid;(5-Bromo-3-pyridyl)boronic acid;(5-bromo-3-pyridinyl)boronic acid; |
| EINECS: | -0 |
| Density: | 1.78 g/cm3 |
| Melting Point: | >300 ºC |
| Boiling Point: | 351.5 ºC at 760 mmHg |
| Flash Point: | 166.4 ºC |
| Appearance: | white to light yellow crystal powder |
| Hazard Symbols: |
 Xi
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| Risk Codes: | 36/37/38 |
| Safety: | 26-36 |
| PSA: | 53.35000 |
| LogP: | -0.47610 |
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Specification
The 3-Bromopyridine-5-boronic acid, also known as 5-Bromopyridine-3-boronic acid, is an organic compound with the formula C5H5BBrNO2. It belongs to the product categories of Boronicacid; Blocks; Boronic Acids; Pyridines; Boronic Acids; Halogenated; Organoborons; Pyridine; Boronic Acids; Boronic Acids and Derivatives; Heteroaryl. With the CAS registry number 452972-09-7, its IUPAC name is (5-bromopyridin-3-yl)boronic acid. The product should be sealed and stored in cool and dry place.
Physical properties of 3-Bromopyridine-5-boronic acid: (1)ACD/LogP: 1.12; (2)#H bond acceptors: 3; (3)#H bond donors: 2; (4)#Freely Rotating Bonds: 3; (5)Index of Refraction: 1.602; (6)Molar Refractivity: 38.8 cm3; (7)Molar Volume: 113 cm3; (8)Surface Tension: 62.7 dyne/cm; (9)Density: 1.78 g/cm3; (10)Flash Point: 166.4 °C; (11)Enthalpy of Vaporization: 62.92 kJ/mol; (12)Boiling Point: 351.5 °C at 760 mmHg; (13)Vapour Pressure: 1.52E-05 mmHg at 25°C.
When you are using this chemical, please be cautious about it as the following:
This chemical may cause inflammation to the skin or other mucous membranes. It is irritating to eyes, respiratory system and skin. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. Whenever you will contact it, please wear suitable protective clothing.
You can still convert the following datas into molecular structure:
(1)Canonical SMILES: B(C1=CC(=CN=C1)Br)(O)O
(2)InChI: InChI=1S/C5H5BBrNO2/c7-5-1-4(6(9)10)2-8-3-5/h1-3,9-10H
(3)InChIKey: ICCGFOKNFZWCTJ-UHFFFAOYSA-N