The Fmoc-N-Me-Tyr(Tbu)-OH, with CAS registry number 133373-24-7, belongs to the following product categories: (1)Tyrosine [Tyr, Y]; (2)N-Methyl Amino Acids; (3)Fmoc-Amino acid series. It has the systematic name of (2S)-3-(4-tert-butoxyphenyl)-2-[9H-fluoren-9-ylmethoxycarbonyl(methyl)amino]propanoic acid. This chemical should be stored at the temperature of 0-5°C. And the chemical formula of this chemical is C29H31NO5.
Physical properties of Fmoc-N-Me-Tyr(Tbu)-OH: (1)ACD/LogP: 7.04; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 4.98; (4)ACD/LogD (pH 7.4): 3.49; (5)#H bond acceptors: 6; (6)#H bond donors: 1; (7)#Freely Rotating Bonds: 9; (8)Polar Surface Area: 76.07 Å2; (9)Index of Refraction: 1.597; (10)Molar Refractivity: 133.7 cm3; (11)Molar Volume: 391.9 cm3; (12)Polarizability: 53×10-24cm3; (13)Surface Tension: 50.1 dyne/cm; (14)Density: 1.208 g/cm3; (15)Flash Point: 340.2 °C; (16)Enthalpy of Vaporization: 99.16 kJ/mol; (17)Boiling Point: 638.9 °C at 760 mmHg; (18)Vapour Pressure: 3.38E-17 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: CC(C)(C)Oc1ccc(cc1)CC(C(=O)O)N(C)C(=O)OCC2c3ccccc3-c4c2cccc4
(2)InChI: InChI=1/C29H31NO5/c1-29(2,3)35-20-15-13-19(14-16-20)17-26(27(31)32)30(4)28(33)34-18-25-23-11-7-5-9-21(23)22-10-6-8-12-24(22)25/h5-16,25-26H,17-18H2,1-4H3,(H,31,32)/t26-/m0/s1
(3)InChIKey: WTLSDEYZKFJXFT-SANMLTNEBR
(4)Std. InChI: InChI=1S/C29H31NO5/c1-29(2,3)35-20-15-13-19(14-16-20)17-26(27(31)32)30(4)28(33)34-18-25-23-11-7-5-9-21(23)22-10-6-8-12-24(22)25/h5-16,25-26H,17-18H2,1-4H3,(H,31,32)/t26-/m0/s1
(5)Std. InChIKey: WTLSDEYZKFJXFT-SANMLTNESA-N
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