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Cas Database |
| Name |
4-(1,3,2-Dioxaborinan-2-yl)benzoic acid |
EINECS | N/A |
| CAS No. | 126747-13-5 | Density | 1.24g/cm3 |
| PSA | 55.76000 | LogP | 0.51690 |
| Solubility | N/A | Melting Point |
211-213 °C |
| Formula | C10H11BO4 | Boiling Point | 398.808 °C at 760 mmHg |
| Molecular Weight | 206.006 | Flash Point | 194.992 °C |
| Transport Information | N/A | Appearance | white crystal powder |
| Safety | Risk Codes | N/A | |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
2-(4-Carboxyphenyl)-1,3,2-dioxaborinane; |
Article Data | 4 |
4-(1,3,2-Dioxaborinan-2-yl)benzoic acid Specification
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
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