FMOC-2-NAL-OH

The IUPAC name of (S)-N-Fmoc-3-(2-naphthyl)alanine is (2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-naphthalen-2-ylpropanoic acid. With the CAS registry number 112883-43-9, it is also named as Fmoc-3-(2-Naphthyl)-L-alanine. The product's categories are Amino Acids Derivatives; Amino Acids; Phenylalanine Analogs and other Aromatic Alpha Amino Acids; Alanine [Ala, A]; Unusual Amino Acids; Fmoc-Amino Acid Series; A-amino. Besides, it is white to slightly yellow powder, which should be stored in closed container in a cool, dry warehouse at 2-8 °C. In addition, when you are using this chemical, please do not breathe dust. And you should avoid contact with skin and eyes. It is used as a pharmaceutical intermediate.

The other characteristics of (S)-N-Fmoc-3-(2-naphthyl)alanine can be summarized as: (1)ACD/LogP: 6.64; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 4.49; (4)ACD/LogD (pH 7.4): 3.06; (5)ACD/BCF (pH 5.5): 466.47; (6)ACD/BCF (pH 7.4): 17.35; (7)ACD/KOC (pH 5.5): 695.6; (8)ACD/KOC (pH 7.4): 25.87; (9)#H bond acceptors: 5; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 7; (12)Index of Refraction: 1.671; (13)Molar Refractivity: 126.24 cm³; (14)Molar Volume: 337.5 cm³; (15)Surface Tension: 59.6 dyne/cm; (16)Density: 1.296 g/cm³; (17)Flash Point: 371.6 °C; (18)Melting point: 155 °C; (19)Enthalpy of Vaporization: 106.31 kJ/mol; (20)Boiling Point: 690.7 °C at 760 mmHg; (21)Vapour Pressure: 4.95E-20 mmHg at 25 °C.

People can use the following data to convert to the molecule structure.
(1)SMILES: O=C(O)[C@@H](NC(=O)OCC3c1ccccc1c2c3cccc2)Cc5cc4ccccc4cc5
(2)InChI: InChI=1/C28H23NO4/c30-27(31)26(16-18-13-14-19-7-1-2-8-20(19)15-18)29-28(32)33-17-25-23-11-5-3-9-21(23)22-10-4-6-12-24(22)25/h1-15,25-26H,16-17H2,(H,29,32)(H,30,31)/t26-/m0/s1
(3)InChIKey: JYUTZJVERLGMQZ-SANMLTNEBW
(4)Std. InChI: InChI=1S/C28H23NO4/c30-27(31)26(16-18-13-14-19-7-1-2-8-20(19)15-18)29-28(32)33-17-25-23-11-5-3-9-21(23)22-10-4-6-12-24(22)25/h1-15,25-26H,16-17H2,(H,29,32)(H,30,31)/t26-/m0/s1
(5)Std. InChIKey: JYUTZJVERLGMQZ-SANMLTNESA-N