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55096-88-3

Basic Information
CAS No.: 55096-88-3
Name: Benzenemethanamine,4-fluoro-N-(phenylmethyl)-
Article Data: 26
Cas Database
Molecular Structure:
Molecular Structure of 55096-88-3 (Benzenemethanamine,4-fluoro-N-(phenylmethyl)-)
Formula: C14H14FN
Molecular Weight: 215.27
Synonyms: Benzyl(4-fluorobenzyl)amine;4-Fluorodibenzylamine;N-Benzyl-4-fluorobenzylamine;
EINECS: N/A
Density: 1.098g/cm3
Melting Point: N/A
Boiling Point: 309.5 °C at 760 mmHg
Flash Point: 141 °C
Solubility: N/A
Appearance: N/A
Hazard Symbols: IrritantXi
Risk Codes: N/A
Safety:
Transport Information: N/A
PSA: 12.03000
LogP: 3.50640
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Specification

The Benzenemethanamine,4-fluoro-N-(phenylmethyl)-, with CAS registry number 55096-88-3, has the systematic name of N-benzyl-1-(4-fluorophenyl)methanamine. Besides this, it is also called Benzyl-(4-fluoro-benzyl)-amine. Its molecular weight is 216.2735. And the chemical formula of this chemical is C14H14FN.

Physical properties of Benzenemethanamine,4-fluoro-N-(phenylmethyl)-: (1)ACD/LogP: 3.47; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 1; (4)#H bond donors: 1; (5)#Freely Rotating Bonds: 4; (6)Polar Surface Area: 3.24 Å2; (7)Index of Refraction: 1.565; (8)Molar Refractivity: 63.87 cm3; (9)Molar Volume: 195.9 cm3; (10)Polarizability: 25.32×10-24cm3; (11)Surface Tension: 39.4 dyne/cm; (12)Density: 1.098 g/cm3; (13)Flash Point: 141 °C; (14)Enthalpy of Vaporization: 55.03 kJ/mol; (15)Boiling Point: 309.5 °C at 760 mmHg; (16)Vapour Pressure: 0.000637 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Fc1ccc(cc1)CNCc2ccccc2
(2)InChI: InChI=1/C14H14FN/c15-14-8-6-13(7-9-14)11-16-10-12-4-2-1-3-5-12/h1-9,16H,10-11H2
(3)InChIKey: SXZSRGKJZKOZRP-UHFFFAOYAV
(4)Std. InChI: InChI=1S/C14H14FN/c15-14-8-6-13(7-9-14)11-16-10-12-4-2-1-3-5-12/h1-9,16H,10-11H2
(5)Std. InChIKey: SXZSRGKJZKOZRP-UHFFFAOYSA-N