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| CAS No.: | 846023-58-3 |
|---|---|
| Name: | 5-FORMYLFURAN-3-BORONIC ACID PINACOL ESTER |
| Article Data: | 2 |
| Molecular Structure: | |
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| Formula: | C11H15BO4 |
| Molecular Weight: | 222.049 |
| Synonyms: | 4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)furan-2-carbaldehyde;2-Formylfuran-4-boronic acid pinacol ester; |
| Density: | 1.1 g/cm3 |
| Boiling Point: | 338.1 °C at 760 mmHg |
| Flash Point: | 158.3 °C |
| Hazard Symbols: |
 Xi
|
| PSA: | 48.67000 |
| LogP: | 1.39130 |
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- Total:29 Page 1 of 1 1
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Specification
The 2-Furancarboxaldehyde,4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)- with CAS registry number of 846023-58-3 is also known as 5-Formylfuran-3-boronic acid pinacol ester. The systematic name is 4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)furan-2-carbaldehyde. It belongs to product categories of Furan; Organoborons. In addition, the formula is C11H15BO4 and the molecular weight is 222.05. What's more, this chemical may cause inflammation to the skin or other mucous membranes.
Physical properties about 2-Furancarboxaldehyde,4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)- are: (1)#H bond acceptors: 4; (2)#H bond donors: 0; (3)#Freely Rotating Bonds: 2; (4)Polar Surface Area: 48.67Å2; (5)Index of Refraction: 1.479; (6)Molar Refractivity: 56.9 cm3; (7)Molar Volume: 200.6 cm3; (8)Polarizability: 22.56×10-24cm3; (9)Surface Tension: 33.9 dyne/cm; (10)Density: 1.1 g/cm3; (11)Flash Point: 158.3 °C; (12)Enthalpy of Vaporization: 58.14 kJ/mol; (13)Boiling Point: 338.1 °C at 760 mmHg; (14)Vapour Pressure: 0.0001 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
1. SMILES: O=Cc2occ(B1OC(C)(C)C(O1)(C)C)c2
2. InChI: InChI=1/C11H15BO4/c1-10(2)11(3,4)16-12(15-10)8-5-9(6-13)14-7-8/h5-7H,1-4H3
3. InChIKey: YHEMDDZDHYKQGZ-UHFFFAOYAW
4. Std. InChI: InChI=1S/C11H15BO4/c1-10(2)11(3,4)16-12(15-10)8-5-9(6-13)14-7-8/h5-7H,1-4H3
5. Std. InChIKey: YHEMDDZDHYKQGZ-UHFFFAOYSA-N