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6096-89-5

Basic Information
CAS No.: 6096-89-5
Name: 2-(4-FLUORO-PHENOXY)-ETHYLAMINE
Article Data: 9
Molecular Structure:
Molecular Structure of 6096-89-5 (2-(4-FLUORO-PHENOXY)-ETHYLAMINE)
Formula: C8H10FNO
Molecular Weight: 155.172
Synonyms: 2-(4-fluorophenoxy)ethanamine;
Density: 1.126 g/cm3
Boiling Point: 246.577 °C at 760 mmHg
Flash Point: 102.926 °C
Hazard Symbols: IrritantXi
PSA: 35.25000
LogP: 1.86350
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Specification

This chemical is called 2-(4-Fluorphenoxy)ethanamin, and it's also named as Ethanamine, 2-(4-fluorophenoxy)-. With the molecular formula of C8H10FNO, its molecular weight is 155.17. The CAS registry number of this chemical is 6096-89-5.

Other characteristics of the 2-(4-Fluorphenoxy)ethanamin can be summarised as followings: (1)ACD/LogP: 1.00; (2)# of Rule of 5 Violations: 0; (3)ACD/BCF (pH 5.5): 1; (4)ACD/BCF (pH 7.4): 1; (5)ACD/KOC (pH 5.5): 1; (6)ACD/KOC (pH 7.4): 1; (7)#H bond acceptors: 2; (8)#H bond donors: 2; (9)#Freely Rotating Bonds: 4; (10)Polar Surface Area: 35.25 Å2; (11)Index of Refraction: 1.508; (12)Molar Refractivity: 41.093 cm3; (13)Molar Volume: 137.83 cm3; (14)Polarizability: 16.291×10-24cm3; (15)Surface Tension: 36.98 dyne/cm; (16)Density: 1.126 g/cm3; (17)Flash Point: 102.926 °C; (18)Enthalpy of Vaporization: 48.37 kJ/mol; (19)Boiling Point: 246.577 °C at 760 mmHg; (20)Vapour Pressure: 0.027 mmHg at 25°C.

You can still convert the following datas into molecular structure: 
1.SMILES: c1cc(ccc1OCCN)F
2.InChI: InChI=1/C8H10FNO/c9-7-1-3-8(4-2-7)11-6-5-10/h1-4H,5-6,10H2
3.InChIKey: HTMIRIIZZGJJBK-UHFFFAOYAR