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CAS No.: | 913836-27-8 |
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Name: | 4-(2-BROMOETHOXY)PHENYLBORONIC ACID PINACOL ESTER |
Article Data: | 2 |
Molecular Structure: | |
Formula: | C14H20BBrO3 |
Molecular Weight: | 327.026 |
Synonyms: | 2-[4-(2-Bromoethoxy)phenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane; |
Density: | 1.27g/cm3 |
Melting Point: | 90-92°C |
Boiling Point: | 391.9 °C at 760 mmHg |
Flash Point: | 190.8 °C |
Hazard Symbols: | Xi |
PSA: | 27.69000 |
LogP: | 2.75950 |
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The 1,3,2-Dioxaborolane,2-[4-(2-bromoethoxy)phenyl]-4,4,5,5-tetramethyl-, with CAS registry number 913836-27-8, belongs to the following product categories: (1)Blocks; (2)Boronic Acids; (3)Bromides. It has the systematic name of 2-[4-(2-bromoethoxy)phenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane. And the chemical formula of this chemical is C14H20BBrO3.
Physical properties of 1,3,2-Dioxaborolane,2-[4-(2-bromoethoxy)phenyl]-4,4,5,5-tetramethyl-: (1)#H bond acceptors: 3; (2)#H bond donors: 0; (3)#Freely Rotating Bonds: 4; (4)Polar Surface Area: 27.69 Å2; (5)Index of Refraction: 1.52; (6)Molar Refractivity: 78.18 cm3; (7)Molar Volume: 256.9 cm3; (8)Polarizability: 30.99×10-24cm3; (9)Surface Tension: 36.9 dyne/cm; (10)Density: 1.27 g/cm3; (11)Flash Point: 190.8 °C; (12)Enthalpy of Vaporization: 61.65 kJ/mol; (13)Boiling Point: 391.9 °C at 760 mmHg; (14)Vapour Pressure: 5.38E-06 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: B1(OC(C(O1)(C)C)(C)C)c2ccc(cc2)OCCBr
(2)InChI: InChI=1/C14H20BBrO3/c1-13(2)14(3,4)19-15(18-13)11-5-7-12(8-6-11)17-10-9-16/h5-8H,9-10H2,1-4H3
(3)InChIKey: NTTOMYNPPZBRBG-UHFFFAOYAL
(4)Std. InChI: InChI=1S/C14H20BBrO3/c1-13(2)14(3,4)19-15(18-13)11-5-7-12(8-6-11)17-10-9-16/h5-8H,9-10H2,1-4H3
(5)Std. InChIKey: NTTOMYNPPZBRBG-UHFFFAOYSA-N