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Cas Database |
| Name |
2-Bromo-9,9-diethylfluorene |
EINECS | 1312995-182-4 |
| CAS No. | 287493-15-6 | Density | 1.265 g/cm3 |
| PSA | 0.00000 | LogP | 5.53560 |
| Solubility | N/A | Melting Point |
52.0 to 56.0 °C |
| Formula | C17H17Br | Boiling Point | 381.033 °C at 760 mmHg |
| Molecular Weight | 301.226 | Flash Point | 179.671 °C |
| Transport Information | N/A | Appearance | N/A |
| Safety | Risk Codes | N/A | |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
2-Bromo-9,9-diethyl-9H-fluorene;2-Bromo-9,9-diethylfluorene; |
Article Data | 22 |
2-Bromo-9,9-diethylfluorene Specification
The 2-Bromo-9,9-diethylfluorene with the CAS number 287493-15-6 is also called 9H-Fluorene,2-bromo-9,9-diethyl-. The systematic name is 2-bromo-9,9-diethyl-9H-fluorene. Its molecular formula is C17H17Br. The product category is Electronic Chemicals.
The properties of the chemical are: (1)ACD/LogP: 7.67; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 7; (4)ACD/LogD (pH 7.4): 7; (5)ACD/BCF (pH 5.5): 129869; (6)ACD/BCF (pH 7.4): 129869; (7)ACD/KOC (pH 5.5): 159156; (8)ACD/KOC (pH 7.4): 159156; (9)#H bond acceptors: 0; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 0 Å2; (13)Index of Refraction: 1.587; (14)Molar Refractivity: 80.044 cm3; (15)Molar Volume: 238.092 cm3; (16)Polarizability: 31.732×10-24cm3; (17)Surface Tension: 43.053 dyne/cm; (18)Enthalpy of Vaporization: 60.461 kJ/mol; (19)Vapour Pressure: 0 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Brc2ccc3c1ccccc1C(CC)(CC)c3c2
(2)InChI: InChI=1/C17H17Br/c1-3-17(4-2)15-8-6-5-7-13(15)14-10-9-12(18)11-16(14)17/h5-11H,3-4H2,1-2H3
(3)InChIKey: HJXPGCTYMKCLTR-UHFFFAOYAV
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