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3,5-Difluoro-4'-propylbiphenyl

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Name

3,5-Difluoro-4'-propylbiphenyl

EINECS N/A
CAS No. 137528-87-1 Density 1.093 g/cm3
PSA 0.00000 LogP 4.58430
Solubility N/A Melting Point 25.015℃ (acetic acid )
Formula C15H14F2 Boiling Point 302.805 °C at 760 mmHg
Molecular Weight 232.273 Flash Point 114.183 °C
Transport Information N/A Appearance White solid
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 137528-87-1 (3,5-difluoro-4'-propylbihenyl) Hazard Symbols N/A
Synonyms

3,5-difluoro-4'-propylbihenyl

Article Data 4

3,5-Difluoro-4'-propylbiphenyl Specification

This chemical is called 3,5-Difluoro-4'-propylbiphenyl, and it can also be named as 1,1'-biphenyl, 3,5-difluoro-4'-propyl-. With the molecular formula of C15H14F2, its molecular weight is 232.27. The CAS registry number of this chemical is 137528-87-1.

Other characteristics of the 3,5-Difluoro-4'-propylbiphenyl can be summarised as followings: (1)ACD/LogP: 5.51; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 6; (4)ACD/LogD (pH 7.4): 6; (5)ACD/BCF (pH 5.5): 22988; (6)ACD/BCF (pH 7.4): 22988; (7)ACD/KOC (pH 5.5): 46084; (8)ACD/KOC (pH 7.4): 46084; (9)#H bond acceptors: 0; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 0 Å2; (13)Index of Refraction: 1.524; (14)Molar Refractivity: 65.014 cm3; (15)Molar Volume: 212.462 cm3; (16)Polarizability: 25.774×10-24cm3; (17)Surface Tension: 33.531 dyne/cm; (18)Density: 1.093 g/cm3; (19)Flash Point: 114.183 °C; (20)Enthalpy of Vaporization: 52.135 kJ/mol; (21)Boiling Point: 302.805 °C at 760 mmHg; (22)Vapour Pressure: 0.002 mmHg at 25°C.

You can still convert the following datas into molecular structure: 
1.SMILES: Fc1cc(cc(F)c1)c2ccc(CCC)cc2
2.InChI: InChI=1/C15H14F2/c1-2-3-11-4-6-12(7-5-11)13-8-14(16)10-15(17)9-13/h4-10H,2-3H2,1H3
3.InChIKey: MSYHVNATNGNOOY-UHFFFAOYAL

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