(S)-2-AMINO-3-(3,4-DIMETHOXY-PHENYL)-PROPIONIC ACID

The Tyrosine,3-methoxy-O-methyl-, with CAS registry number 55-59-4, has the systematic name of 3-methoxy-O-methyl-L-tyrosine. Besides this, it is also called (S)-2-Amino-3-(3,4-dimethoxy-phenyl)-propionic acid. And the chemical formula of this chemical is C₁₁H₁₅NO₄.

Physical properties of Tyrosine,3-methoxy-O-methyl-: (1)ACD/LogP: -0.31; (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: 5; (8)#H bond donors: 3; (9)#Freely Rotating Bonds: 6; (10)Polar Surface Area: 81.78 Å²; (11)Index of Refraction: 1.547; (12)Molar Refractivity: 58.85 cm³; (13)Molar Volume: 185.442 cm³; (14)Polarizability: 23.33×10^-24cm³; (15)Surface Tension: 46.868 dyne/cm; (16)Density: 1.215 g/cm³; (17)Flash Point: 180.18 °C; (18)Enthalpy of Vaporization: 65.585 kJ/mol; (19)Boiling Point: 374.316 °C at 760 mmHg; (20)Vapour Pressure: 0 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
The Tyrosine,3-methoxy-O-methyl- irritates to eyes, respiratory system and skin. When use it, wear suitable protective clothing, gloves and eye/face protection. If contact with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(O)[C@@H](N)Cc1cc(OC)c(OC)cc1
(2)InChI: InChI=1/C11H15NO4/c1-15-9-4-3-7(6-10(9)16-2)5-8(12)11(13)14/h3-4,6,8H,5,12H2,1-2H3,(H,13,14)/t8-/m0/s1
(3)InChIKey: VWTFNYVAFGYEKI-QMMMGPOBBG
(4)Std. InChI: InChI=1S/C11H15NO4/c1-15-9-4-3-7(6-10(9)16-2)5-8(12)11(13)14/h3-4,6,8H,5,12H2,1-2H3,(H,13,14)/t8-/m0/s1
(5)Std. InChIKey: VWTFNYVAFGYEKI-QMMMGPOBSA-N