4-Fluorodiphenyl sulfide supplier

Name
4-FLUORO DIPHENYL SULFIDE
EINECS
CAS No. 330-85-8
Article Data73
CAS DataBase
Density 1.2 g/cm³
Solubility
Melting Point
Formula C₁₂H₉FS
Boiling Point 308.1 °C at 760 mmHg
Molecular Weight 204.268
Flash Point 140.1 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Sulfide,p-fluorophenyl phenyl (7CI,8CI);p-Fluorophenylphenyl sulfide;4-Fluorophenyl phenyl sulfide;
PSA 25.30000
LogP 3.97690

4-Fluorodiphenyl sulfide Specification

The Benzene,1-fluoro-4-(phenylthio)-, with the CAS registry number 330-85-8, is also known as 4-Fluorophenyl phenyl sulfide. This chemical's molecular formula is C₁₂H₉FS and molecular weight is 204.2632632. What's more, its systematic name is called 1-Fluoro-4-(phenylsulfanyl)benzene.

Physical properties about Benzene,1-fluoro-4-(phenylthio)- are: (1)ACD/LogP: 3.38; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 5; (4)ACD/LogD (pH 7.4): 5; (5)ACD/BCF (pH 5.5): 2364; (6)ACD/BCF (pH 7.4): 2364; (7)ACD/KOC (pH 5.5): 9047; (8)ACD/KOC (pH 7.4): 9047; (9)#H bond acceptors: 0; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 25.3 Å²; (13)Index of Refraction: 1.621; (14)Molar Refractivity: 59.587 cm³; (15)Molar Volume: 169.336 cm³; (16)Surface Tension: 44.429 dyne/cm; (17)Density: 1.206 g/cm³; (18)Flash Point: 140.114 °C; (19)Enthalpy of Vaporization: 52.681 kJ/mol; (20)Boiling Point: 308.067 °C at 760 mmHg; (21)Vapour Pressure: 0.001 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: Fc2ccc(Sc1ccccc1)cc2
(2) InChI: InChI=1/C12H9FS/c13-10-6-8-12(9-7-10)14-11-4-2-1-3-5-11/h1-9H
(3) InChIKey: GAIVWUFOYSDTHX-UHFFFAOYAB

Product Name

4-FLUORO DIPHENYL SULFIDE

4-Fluorodiphenyl sulfide Specification

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