Products Categories
CAS No.: | 3459-94-7 |
---|---|
Name: | Benzene, 1,4-bis(phenylthio)- |
Article Data: | 42 |
Molecular Structure: | |
Formula: | C18H14S2 |
Molecular Weight: | 294.441 |
Synonyms: | 1,4-Bis(phenylsulfanyl)benzene; |
Density: | 1.23 g/cm3 |
Boiling Point: | 467.5 °C at 760 mmHg |
Flash Point: | 245.6 °C |
What can I do for you?
Get Best Price
The Benzene, 1,4-bis(phenylthio)- has the CAS registry number 3459-94-7. This chemical's molecular formula is C18H14S2 and molecular weight is 294.43. What's more, its systematic name is 1,4-bis(phenylsulfanyl)benzene.
Physical properties of Benzene, 1,4-bis(phenylthio)- are: (1)ACD/LogP: 6.68; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 6.68; (4)ACD/LogD (pH 7.4): 6.68; (5)ACD/BCF (pH 5.5): 70485.72; (6)ACD/BCF (pH 7.4): 70485.72; (7)ACD/KOC (pH 5.5): 102766.44; (8)ACD/KOC (pH 7.4): 102766.44; (9)#H bond acceptors: 0; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 50.6 Å2; (13)Index of Refraction: 1.702; (14)Molar Refractivity: 92.19 cm3; (15)Molar Volume: 237.9 cm3; (16)Polarizability: 36.54×10-24cm3; (17)Surface Tension: 57.2 dyne/cm; (18)Density: 1.23 g/cm3; (19)Flash Point: 245.6 °C; (20)Enthalpy of Vaporization: 70.16 kJ/mol; (21)Boiling Point: 467.5 °C at 760 mmHg; (22)Vapour Pressure: 1.81E-08 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: S(c1ccccc1)c3ccc(Sc2ccccc2)cc3
(2)InChI: InChI=1S/C18H14S2/c1-3-7-15(8-4-1)19-17-11-13-18(14-12-17)20-16-9-5-2-6-10-16/h1-14H
(3)InChIKey: WGBYOWIYAKVOLO-UHFFFAOYSA-N