Fmoc-N-methyl-L-glutamic acid 5-tert-butyl ester

The L-Glutamic acid,N-[(9H-fluoren-9-ylmethoxy)carbonyl]-N-methyl-, 5-(1,1-dimethylethyl) ester, with the CAS registry number 200616-40-6, is also known as N-(9-Fluorenylmethyloxycarbonyl)-N-methyl-L-glutamic acid 5-tert-butyl ester and Fmoc-N-Me-Glu(OtBu)-OH. It belongs to the product categories of Protected Amino Acid & Peptides; Glutamic acid [Glu, E]; N-Methyl Amino Acids and Fmoc-Amino. This chemical's molecular formula is C₂₅H₂₉NO₆ and molecular weight is 439.50. What's more, its systematic name is called (2S)-5-tert-Butoxy-2-(9H-fluoren-9-ylmethoxycarbonyl-methyl-amino)-5-oxo-pentanoic acid.

Physical properties about L-Glutamic acid,N-[(9H-fluoren-9-ylmethoxy)carbonyl]-N-methyl-, 5-(1,1-dimethylethyl) ester are: (1) ACD/LogP: 5.75; (2) # of Rule of 5 Violations: 1; (3) ACD/LogD (pH 5.5): 3.58; (4) ACD/LogD (pH 7.4): 2.17; (5) #H bond acceptors: 7; (6) #H bond donors: 1; (7) #Freely Rotating Bonds: 10; (8) Polar Surface Area: 93.14 Å²; (9) Index of Refraction: 1.57; (10) Molar Refractivity: 118.21 cm³; (11) Molar Volume: 360.2 cm³; (12) Surface Tension: 50 dyne/cm; (13) Density: 1.22 g/cm³; (14) Flash Point: 324.1 °C ; (15) Enthalpy of Vaporization: 95.56 kJ/mol; (16) Boiling Point: 612.3 °C at 760 mmHg; (17) Vapour Pressure: 7.58E-16 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: OC(=O)[C@H](CCC(=O)OC(C)(C)C)N(C)C(=O)OCC3c1ccccc1c2ccccc23
(2) InChI: InChI=1/C25H29NO6/c1-25(2,3)32-22(27)14-13-21(23(28)29)26(4)24(30)31-15-20-18-11-7-5-9-16(18)17-10-6-8-12-19(17)20/h5-12,20-21H,13-15H2,1-4H3,(H,28,29)/t21-/m0/s1
(3) InChIKey: FVUASVBQADLDRO-NRFANRHFBX