The 2-Furanmethanamine,N-[(4-methoxyphenyl)methyl]-, with CAS registry number 225236-03-3, has the systematic name of 1-(furan-2-yl)-N-(4-methoxybenzyl)methanamine. Besides this, it is also called Furan-2-ylmethyl-(4-methoxy-benzyl)-amine. And the chemical formula of this chemical is C13H15NO2.
Physical properties of 2-Furanmethanamine,N-[(4-methoxyphenyl)methyl]-: (1)ACD/LogP: 2.50; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 3; (4)#H bond donors: 1; (5)#Freely Rotating Bonds: 5; (6)Polar Surface Area: 25.61 Å2; (7)Index of Refraction: 1.545; (8)Molar Refractivity: 62.86 cm3; (9)Molar Volume: 198.5 cm3; (10)Polarizability: 24.92×10-24cm3; (11)Surface Tension: 38.5 dyne/cm; (12)Density: 1.094 g/cm3; (13)Flash Point: 147.8 °C; (14)Enthalpy of Vaporization: 56.24 kJ/mol; (15)Boiling Point: 320.7 °C at 760 mmHg; (16)Vapour Pressure: 0.000312 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: O(c1ccc(cc1)CNCc2occc2)C
(2)InChI: InChI=1/C13H15NO2/c1-15-12-6-4-11(5-7-12)9-14-10-13-3-2-8-16-13/h2-8,14H,9-10H2,1H3
(3)InChIKey: NXCLTNSLLMYDPB-UHFFFAOYAH
(4)Std. InChI: InChI=1S/C13H15NO2/c1-15-12-6-4-11(5-7-12)9-14-10-13-3-2-8-16-13/h2-8,14H,9-10H2,1H3
(5)Std. InChIKey: NXCLTNSLLMYDPB-UHFFFAOYSA-N
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