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| CAS No.: | 867044-28-8 |
|---|---|
| Name: | 9,10-Bis(2-naphthyl)anthracene-2-ylboronic acid |
| Article Data: | 11 |
| Molecular Structure: | |
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| Formula: | C34H23 B O2 |
| Molecular Weight: | 474.366 |
| Synonyms: | Boronicacid, (9,10-di-2-naphthalenyl-2-anthracenyl)- (9CI); |
| EINECS: | 1533716-785-6 |
| Density: | 1.32 g/cm3 |
| Boiling Point: | 685.5 °C at 760 mmHg |
| Flash Point: | 368.4 °C |
| PSA: | 40.46000 |
| LogP: | 7.31320 |
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Specification
The 9,10-Bis(2-naphthyl)anthracene-2-ylboronic acid, with the cas registry number 867044-28-8, has the systematic name of (9,10-dinaphthalen-2-ylanthracen-2-yl)boronic acid. And its product categories are including Electronic Chemicals.
The characteristics of this kind of chemical are as follows: (1)ACD/LogP: 10.03; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 10.03; (4)ACD/LogD (pH 7.4): 9.99; (5)#H bond acceptors: 2; (6)#H bond donors: 2; (7)#Freely Rotating Bonds: 5; (8)Polar Surface Area: 40.46 ; (9)Index of Refraction: 1.799; (10)Molar Refractivity: 152.92 cm3; (11)Molar Volume: 357.7 cm3; (12)Polarizability: 60.62 ×10-24 cm3; (13)Surface Tension: 70.1 dyne/cm; (14)Density: 1.32 g/cm3; (15)Flash Point: 368.4 °C; (16)Enthalpy of Vaporization: 105.58 kJ/mol; (17)Boiling Point: 685.5 °C at 760 mmHg; (18)Vapour Pressure: 9.83E-20 mmHg at 25°C.
Additionally, the following datas could be converted into the molecular structure:
(1)SMILES:OB(O)c4ccc5c(c1cc2ccccc2cc1)c3ccccc3c(c5c4)c6ccc7ccccc7c6
(2)InChI:InChI=1/C34H23BO2/c36-35(37)28-17-18-31-32(21-28)34(27-16-14-23-8-2-4-10-25(23)20-27)30-12-6-5-11-29(30)33(31)26-15-13-22-7-1-3-9-24(22)19-26/h1-21,36-37H
(3)InChIKey:NVPJWLBDGLWXCH-UHFFFAOYAJ