D-Phenylalanine,2-methoxy- (170642-31-6)

The (R)-2-Amino-3-(2-methoxyphenyl)propanoic acid is an organic compound with the formula C₁₀H₁₃NO₃. The systematic name of this chemical is 2-methoxyphenylalanine. With the CAS registry number 170642-31-6, it is also named as 2-Methoxy-D-Phenylalanine.

Physical properties about (R)-2-Amino-3-(2-methoxyphenyl)propanoic acid are: (1)ACD/LogP: 1.03; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 1; (5)ACD/KOC (pH 7.4): 1; (6)#H bond acceptors: 4; (7)#H bond donors: 3; (8)#Freely Rotating Bonds: 5; (9)Polar Surface Area: 38.77 Å²; (10)Index of Refraction: 1.559; (11)Molar Refractivity: 52.17 cm³; (12)Molar Volume: 161.4 cm³; (13)Polarizability: 20.68×10^-24cm³; (14)Surface Tension: 49.6 dyne/cm; (15)Density: 1.209 g/cm³; (16)Flash Point: 157.8 °C; (17)Enthalpy of Vaporization: 61.27 kJ/mol; (18)Boiling Point: 337.2 °C at 760 mmHg; (19)Vapour Pressure: 4.16E-05 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(O)C(N)Cc1ccccc1OC
(2)InChI: InChI=1/C10H13NO3/c1-14-9-5-3-2-4-7(9)6-8(11)10(12)13/h2-5,8H,6,11H2,1H3,(H,12,13)
(3)InChIKey: SEUPQWHWULSGJC-UHFFFAOYAR
(4)Std. InChI: InChI=1S/C10H13NO3/c1-14-9-5-3-2-4-7(9)6-8(11)10(12)13/h2-5,8H,6,11H2,1H3,(H,12,13)
(5)Std. InChIKey: SEUPQWHWULSGJC-UHFFFAOYSA-N