1,3-Diphenylbenzo[c]thiophene supplier

Name
1,3-Diphenylbenzo[c]thiophene
EINECS
CAS No. 16587-39-6
Article Data7
CAS DataBase
Density 1.176 g/cm³
Solubility
Melting Point 114-119 °C
Formula C₂₀H₁₆S
Boiling Point 457.371 °C at 760 mmHg
Molecular Weight 286.397
Flash Point 173.945 °C
Transport Information
Appearance yellow fluffy powder
Safety 24/25
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 1,3-Diphenylbenzo[c]thiophene;1,3-Diphenylisobenzothiophene;1,3-Diphenylisothianaphthene;1,3-Diphenylisothiobenzofuran;NSC 135959;
PSA 25.30000
LogP 5.62800

1,3-Diphenylbenzo[c]thiophene Specification

This chemical is called 1,3-Diphenyl-2-benzothiophene, and its CAS registry number is 16587-39-6. With the molecular formula of C₂₀H₁₆S, its molecular weight is 288.41. In addition, this chemical should be sealed in the cool and dry plcace. If you use this chemical, please avoid contacting with skin and eyes.

Other characteristics of the 1,3-Diphenyl-2-benzothiophene can be summarised as followings: (1)ACD/LogP: 7.18; (2)# of Rule of 5 Violations: 1; (3)#H bond acceptors: 0; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 2; (6)Polar Surface Area: 28.24 Å²; (7)Index of Refraction: 1.676; (8)Molar Refractivity: 91.66 cm³; (9)Molar Volume: 243.5 cm³; (10)Polarizability: 36.33×10^-24cm³; (11)Surface Tension: 47.9 dyne/cm; (12)Density: 1.175 g/cm³; (13)Flash Point: 173.9 °C; (14)Enthalpy of Vaporization: 69 kJ/mol; (15)Boiling Point: 457.4 °C at 760 mmHg; (16)Vapour Pressure: 4.07E-08 mmHg at 25°C.

You can still convert the following datas into molecular structure:
1.SMILES: s2c(c1ccccc1c2c3ccccc3)c4ccccc4
2.InChI: InChI=1/C20H14S/c1-3-9-15(10-4-1)19-17-13-7-8-14-18(17)20(21-19)16-11-5-2-6-12-16/h1-14H
3.InChIKey: RQXSNTYLVXFUAA-UHFFFAOYAN

Product Name

1,3-Diphenylbenzo[c]thiophene

1,3-Diphenylbenzo[c]thiophene Specification

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