CAS No.68285-25-6,(S)-1-(2-FLUOROPHENYL)ETHYLAMINE Suppliers

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Basic Information

Molecular Structure:
CAS No.:	68285-25-6
Name:	(S)-1-(2-FLUOROPHENYL)ETHYLAMINE
Article Data:	16

Formula:	C₈H₁₀FN
Molecular Weight:	139.173
Synonyms:	Benzenemethanamine,2-fluoro-a-methyl-, (S)-;(S)-1-(2-Fluorophenyl)ethanamine;(S)-1-(2-Fluorophenyl)ethylamine;
Density:	1.063 g/cm³
Boiling Point:	179.8 °C at 760 mmHg
Flash Point:	70.2 °C
Hazard Symbols:	Xi
Risk Codes:	52
PSA:	26.02000
LogP:	2.54570

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Specification

The CAS register number of (S)-1-(2-Fluorophenyl)ethylamine is 68285-25-6. It also can be called as Benzenemethanamine,2-fluoro-a-methyl-, (aS)- and the IUPAC name about this chemical is (1S)-1-(2-fluorophenyl)ethanamine.

Physical properties about (S)-1-(2-Fluorophenyl)ethylamine are: (1)ACD/LogP: 1.49; (2)ACD/LogD (pH 5.5): -1.54; (3)ACD/LogD (pH 7.4): -0.41; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 1; (7)ACD/KOC (pH 7.4): 1.95; (8)#H bond acceptors: 1; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 2; (11)Polar Surface Area: 3.24Å²; (12)Index of Refraction: 1.512; (13)Molar Refractivity: 39.33 cm³; (14)Molar Volume: 130.8 cm³; (15)Polarizability: 15.59x10^-24cm³; (16)Surface Tension: 35.1 dyne/cm; (17)Enthalpy of Vaporization: 41.6 kJ/mol; (18)Boiling Point: 179.8 °C at 760 mmHg; (19)Vapour Pressure: 0.926 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Fc1ccccc1[C@@H](N)C
(2)InChI: InChI=1/C8H10FN/c1-6(10)7-4-2-3-5-8(7)9/h2-6H,10H2,1H3/t6-/m0/s1
(3)InChIKey: DIWHJJUFVGEXGS-LURJTMIEBN
(4)Std. InChI: InChI=1S/C8H10FN/c1-6(10)7-4-2-3-5-8(7)9/h2-6H,10H2,1H3/t6-/m0/s1
(5)Std. InChIKey: DIWHJJUFVGEXGS-LURJTMIESA-N