CAS No.126163-02-8,2,3-Difluoro-4'-propylbiphenyl Suppliers

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Basic Information

Molecular Structure:
CAS No.:	126163-02-8
Name:	2,3-Difluoro-4'-propylbiphenyl
Article Data:	5

Formula:	C₁₅H₁₄F₂
Molecular Weight:	232.273
Synonyms:	1,1'-Biphenyl,2,3-difluoro-4'-propyl-;2,3-Difluoro-4'-propyl-1,1'-biphenyl;
Density:	1.093 g/cm³
Boiling Point:	302.1 °C at 760 mmHg
Flash Point:	113.8 °C
PSA:	0.00000
LogP:	4.58430

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Specification

This product is an organic compound with the formula C₁₅H₁₄F₂. The systematic name of this chemical is 2,3-Difluoro-4'-propylbiphenyl. With the CAS registry number 126163-02-8, it is also named as 1,1'-Biphenyl,2,3-difluoro-4'-propyl-. In addition, the molecular weight is 232.27.

Physical properties of 2,3-Difluoro-4'-propylbiphenyl are: (1)ACD/LogP: 6.17; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 6.17; (4)ACD/LogD (pH 7.4): 6.17; (5)ACD/BCF (pH 5.5): 28629.28; (6)ACD/BCF (pH 7.4): 28629.28; (7)ACD/KOC (pH 5.5): 53922.44; (8)ACD/KOC (pH 7.4): 53922.44; (9)#H bond acceptors: 0; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 3; (12)Index of Refraction: 1.524; (13)Molar Refractivity: 65.01 cm³; (14)Molar Volume: 212.4 cm³; (15)Polarizability: 25.77×10^-24cm³; (16)Surface Tension: 33.5 dyne/cm; (17)Density: 1.093 g/cm³; (18)Flash Point: 113.8 °C; (19)Enthalpy of Vaporization: 52.06 kJ/mol; (20)Boiling Point: 302.1 °C at 760 mmHg; (21)Vapour Pressure: 0.00182 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Fc1c(cccc1F)c2ccc(CCC)cc2
(2)Std. InChI: InChI=1S/C15H14F2/c1-2-4-11-7-9-12(10-8-11)13-5-3-6-14(16)15(13)17/h3,5-10H,2,4H2,1H3
(3)Std. InChIKey: YNBZINBCLJAJFS-UHFFFAOYSA-N