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CAS No.: | 126747-13-5 |
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Name: | 2-(4-CARBOXYPHENYL)-1,3,2-DIOXABORINANE |
Article Data: | 4 |
Molecular Structure: | |
Formula: | C10H11BO4 |
Molecular Weight: | 206.006 |
Synonyms: | 2-(4-Carboxyphenyl)-1,3,2-dioxaborinane; |
Density: | 1.24g/cm3 |
Melting Point: | 211-213 °C |
Boiling Point: | 398.808 °C at 760 mmHg |
Flash Point: | 194.992 °C |
Appearance: | white crystal powder |
PSA: | 55.76000 |
LogP: | 0.51690 |
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The 4-(1,3,2-Dioxaborinan-2-yl)benzoic acid with the CAS number 126747-13-5 is also called Benzoic acid,4-(1,3,2-dioxaborinan-2-yl)-. Its molecular formula is C10H11BO4. This chemical is a kind of organics. It should be stored in dry and cool environment.
The properties of the 4-(1,3,2-Dioxaborinan-2-yl)benzoic acid are: (1)#H bond acceptors: 4; (2)#H bond donors: 1; (3)#Freely Rotating Bonds: 2; (4)Polar Surface Area: 55.76 Å2; (5)Index of Refraction: 1.537; (6)Molar Refractivity: 51.829 cm3; (7)Molar Volume: 165.867 cm3; (8)Polarizability: 20.547×10-24cm3; (9)Surface Tension: 44.987 dyne/cm; (10)Enthalpy of Vaporization: 68.489 kJ/mol; (11)Vapour Pressure: 0 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: OC(=O)c1ccc(cc1)B2OCCCO2
(2)InChI: InChI=1/C10H11BO4/c12-10(13)8-2-4-9(5-3-8)11-14-6-1-7-15-11/h2-5H,1,6-7H2,(H,12,13)
(3)InChIKey: YYTULIYDVGLPGK-UHFFFAOYAB