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Name	4-Ethynyl-4'-pentyl-1,1'-biphenyl	EINECS	N/A
CAS No.	80563-43-5	Density	0.99 g/cm³
PSA	0.00000	LogP	5.06760
Solubility	N/A	Melting Point	80 °C(Solv: hexane (110-54-3))
Formula	C₁₉H₂₀	Boiling Point	363.2 °C at 760 mmHg
Molecular Weight	248.368	Flash Point	168.9 °C
Transport Information	N/A	Appearance	N/A
Safety		Risk Codes	N/A
Molecular Structure		Hazard Symbols	N/A
Synonyms	1,1'-biphenyl, 4-ethynyl-4'-pentyl-;	Article Data	3

4-Ethynyl-4'-pentyl-1,1'-biphenyl Specification

The 4-Ethynyl-4'-pentyl-1,1'-biphenyl with the CAS number 80563-43-5 is also called 1,1'-biphenyl, 4-ethynyl-4'-pentyl-. The systematic name is 4-ethynyl-4'-pentylbiphenyl. Its molecular formula is C₁₉H₂₀. This chemical is a kind of organics. It should be stored in dry and cool environment.

The properties of the chemical are: (1)ACD/LogP:6.74; (2)# of Rule of 5 Violations:1 ; (3)#H bond acceptors:0; (4)#H bond donors:0; (5)#Freely Rotating Bonds:5; (6)Polar Surface Area:0 Å²; (7)Index of Refraction:1.569; (8)Molar Refractivity:81.66 cm³; (9)Molar Volume:248.9 cm³; (10)Polarizability:32.37×10^-24cm³; (11)Surface Tension:41.9 dyne/cm; (12)Enthalpy of Vaporization:58.53 kJ/mol; (13)Vapour Pressure:3.83×10^-5 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: C#Cc2ccc(c1ccc(cc1)CCCCC)cc2
(2)InChI: InChI=1/C19H20/c1-3-5-6-7-17-10-14-19(15-11-17)18-12-8-16(4-2)9-13-18/h2,8-15H,3,5-7H2,1H3
(3)InChIKey: SVHXPGWTCYKGGU-UHFFFAOYAC

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