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CAS No.: | 131534-65-1 |
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Name: | PYRIDINE-3-BORONIC ACID 1,3-PROPANEDIOL CYCLIC ESTER |
Molecular Structure: | |
Formula: | C8H10BNO2 |
Molecular Weight: | 162.984 |
Synonyms: | 1,3,2-Dioxaborinane,pyridine deriv.;(3-Pyridyl)boronic acid propane-1,3-diol ester;2-(Pyridin-3-yl)-1,3,2-dioxaborinane;3-(1,3,2-Dioxaborinan-2-yl)pyridine;Pyridine-3-boronic acid 1,3-propanediol cyclic ester;Pyridine-3-boronic acid1,3-propanediol ester;Pyridine-3-boronic acid 1,3-propanediol ring ester; |
EINECS: | -0 |
Density: | 1.1 g/cm3 |
Melting Point: | 95-99 °C(lit.) |
Boiling Point: | 309.5 °C at 760 mmHg |
Flash Point: | 141 °C |
Hazard Symbols: | Xi |
Risk Codes: | 36/37/38 |
Safety: | 22-24/25 |
PSA: | 31.35000 |
LogP: | 0.21370 |
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The Pyridine,3-(1,3,2-dioxaborinan-2-yl)-, with CAS registry number 131534-65-1, has the systematic name of 3-(1,3,2-dioxaborinan-2-yl)pyridine. Besides this, it is also called Pyridine-3-boronic acid 1,3-propanediol cyclic ester. And the chemical formula of this chemical is C8H10BNO2.
Physical properties of Pyridine,3-(1,3,2-dioxaborinan-2-yl)-: (1)#H bond acceptors: 3; (2)#H bond donors: 0; (3)#Freely Rotating Bonds: 1; (4)Polar Surface Area: 31.35 Å2; (5)Index of Refraction: 1.497; (6)Molar Refractivity: 43.35 cm3; (7)Molar Volume: 148.1 cm3; (8)Polarizability: 17.18×10-24cm3; (9)Surface Tension: 36.7 dyne/cm; (10)Density: 1.1 g/cm3; (11)Flash Point: 141 °C; (12)Enthalpy of Vaporization: 52.84 kJ/mol; (13)Boiling Point: 309.5 °C at 760 mmHg; (14)Vapour Pressure: 0.00116 mmHg at 25°C.
When you are using this chemical, please be cautious about it as the following:
The Pyridine,3-(1,3,2-dioxaborinan-2-yl)- irritates to eyes, respiratory system and skin. When use it, do not breathe dust and avoid contact with skin and eyes.
You can still convert the following datas into molecular structure:
(1)SMILES: n2cc(B1OCCCO1)ccc2
(2)InChI: InChI=1/C8H10BNO2/c1-3-8(7-10-4-1)9-11-5-2-6-12-9/h1,3-4,7H,2,5-6H2
(3)InChIKey: ZUUZNOFTKGDLLN-UHFFFAOYAM
(4)Std. InChI: InChI=1S/C8H10BNO2/c1-3-8(7-10-4-1)9-11-5-2-6-12-9/h1,3-4,7H,2,5-6H2
(5)Std. InChIKey: ZUUZNOFTKGDLLN-UHFFFAOYSA-N