FMOC-SARCOSINE MONOHYDRATE

The Fmoc-sarcosine monohydrate, with CAS registry number 77128-70-2, belongs to the following product categories: (1)Amino Acid Derivatives; (2)Amino Acids; (3)Sarcosine [Sar]; (4)Unusual Amino Acids. It has the systematic name of N-[(9H-fluoren-9-ylmethoxy)carbonyl]-N-methylglycine. This chemical should be stored at the temperature of 2-8°C. When use this chemical, do not breathe dust and avoid contact with skin and eyes.

Physical properties of Fmoc-sarcosine monohydrate: (1)ACD/LogP: 3.69; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.61; (4)ACD/LogD (pH 7.4): 0.14; (5)ACD/BCF (pH 5.5): 3.14; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 20.32; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 5; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 5; (12)Polar Surface Area: 55.84 Å²; (13)Index of Refraction: 1.615; (14)Molar Refractivity: 84.08 cm³; (15)Molar Volume: 240.7 cm³; (16)Polarizability: 33.33×10^-24cm³; (17)Surface Tension: 57.2 dyne/cm; (18)Density: 1.292 g/cm³; (19)Flash Point: 263.9 °C; (20)Enthalpy of Vaporization: 82.55 kJ/mol; (21)Boiling Point: 512.8 °C at 760 mmHg; (22)Vapour Pressure: 2.44E-11 mmHg at 25°C.

Preparation: this chemical can be prepared by 9H-fluoren-9-ylmethyl chloroformate and sarcosine ; hydrochloride. This reaction will need reagents H₂O, Na₂CO₃ and solvent dioxane. The reaction time is 16 hour(s). The yield is about 90%.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(O)CN(C(=O)OCC3c1ccccc1c2c3cccc2)C
(2)InChI: InChI=1/C18H17NO4/c1-19(10-17(20)21)18(22)23-11-16-14-8-4-2-6-12(14)13-7-3-5-9-15(13)16/h2-9,16H,10-11H2,1H3,(H,20,21)
(3)InChIKey: ZHKQIADIIYMFOZ-UHFFFAOYAK
(4)Std. InChI: InChI=1S/C18H17NO4/c1-19(10-17(20)21)18(22)23-11-16-14-8-4-2-6-12(14)13-7-3-5-9-15(13)16/h2-9,16H,10-11H2,1H3,(H,20,21)
(5)Std. InChIKey: ZHKQIADIIYMFOZ-UHFFFAOYSA-N