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CAS No.: | 2765-14-2 |
---|---|
Name: | 4,4'-DIBROMO-STILBENE |
Article Data: | 7 |
Molecular Structure: | |
Formula: | C14H10Br2 |
Molecular Weight: | 338.041 |
Synonyms: | 1,1'-(E)-Ethene-1,2-diylbis(4-bromobenzene);4,4'-Dibromo-Stilbene; |
Density: | 1.648 g/cm3 |
Melting Point: | 208-210 °C |
Boiling Point: | 392.9 °C at 760 mmHg |
Flash Point: | 224 °C |
PSA: | 0.00000 |
LogP: | 5.38200 |
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The Benzene, 1,1'-[(E)-1,2-ethenediyl]bis[4-bromo-, with the CAS registry number 2765-14-2, is also known as 4,4'-Dibromo-Stilbene. This chemical's molecular formula is C14H10Br2 and molecular weight is 338.04. What's more, its systematic name is 1,1'-(E)-ethene-1,2-diylbis(4-bromobenzene).
Physical properties of Benzene, 1,1'-[(E)-1,2-ethenediyl]bis[4-bromo- are: (1)ACD/LogP: 6.62; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 6.61; (4)ACD/LogD (pH 7.4): 6.61; (5)ACD/BCF (pH 5.5): 62699.57; (6)ACD/BCF (pH 7.4): 62699.57; (7)ACD/KOC (pH 5.5): 94506.77; (8)ACD/KOC (pH 7.4): 94506.77; (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: 1.697; (14)Molar Refractivity: 79.02 cm3; (15)Molar Volume: 205 cm3; (16)Polarizability: 31.32×10-24cm3; (17)Surface Tension: 49.1 dyne/cm; (18)Density: 1.648 g/cm3; (19)Flash Point: 224 °C; (20)Enthalpy of Vaporization: 61.76 kJ/mol; (21)Boiling Point: 392.9 °C at 760 mmHg; (22)Vapour Pressure: 5.01E-06 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Brc2ccc(/C=C/c1ccc(Br)cc1)cc2
(2)Std. InChI: InChI=1S/C14H10Br2/c15-13-7-3-11(4-8-13)1-2-12-5-9-14(16)10-6-12/h1-10H/b2-1+
(3)Std. InChIKey: JEHMPNUQSJNJDL-OWOJBTEDSA-N