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CAS No.: | 86123-10-6 |
---|---|
Name: | Fmoc-D-phenylalanine |
Article Data: | 12 |
Molecular Structure: | |
Formula: | C24H21NO4 |
Molecular Weight: | 387.435 |
Synonyms: | (R)-3-Phenyl-2-[[[(9H-fluoren-9-yl)methoxy]carbonyl]amino]propionicacid;(R)-N-Fmoc-phenylalanine;223: PN: US20070042401 PAGE: 29 claimedprotein;914: PN: WO2006135786 PAGE: 59 claimed protein;D-Fmoc-Phenylalanine;N-(9-Fluorenylmethoxycarbonyl)-D-phenylalanine;Fmoc-D-Phe-Oh; |
EINECS: | 1533716-785-6 |
Density: | 1.276 g/cm3 |
Melting Point: | 181-185 °C |
Boiling Point: | 620.1 °C at 760 mmHg |
Flash Point: | 328.8 °C |
Appearance: | white powder |
Safety: | 22-24/25 |
PSA: | 75.63000 |
LogP: | 4.61190 |
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The Fmoc-D-phenylalanine, with the CAS registry number 86123-10-6, is also known as Fmoc-D-Phe-OH. It belongs to the product categories of Fluorenes, Flurenones; Amino Acids; Phenylalanine [Phe, F]; Fmoc-Amino Acids and Derivatives; Amino Acids (N-Protected); Biochemistry; Fmoc-Amino Acids; Fmoc-Amino Acid Series. This chemical's molecular formula is C24H21NO4 and molecular weight is 387.43. Its IUPAC name is called (2R)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-phenylpropanoate. The product should be sealed and stored in cool, dry place at temperature of 2-8 °C. When you are using this chemical, please be cautious about it. You should not breathe its dust. Besides, you must avoid contacting it with skin and eyes.
Physical properties of Fmoc-D-phenylalanine: (1)ACD/LogP: 5.41; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 3.26; (4)ACD/LogD (pH 7.4): 1.83; (5)ACD/BCF (pH 5.5): 54.14; (6)ACD/BCF (pH 7.4): 2.01; (7)ACD/KOC (pH 5.5): 148.89; (8)ACD/KOC (pH 7.4): 5.54; (9)#H bond acceptors: 5; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 7; (12)Index of Refraction: 1.633; (13)Molar Refractivity: 108.4 cm3; (14)Molar Volume: 303.4 cm3; (15)Surface Tension: 57.1 dyne/cm; (16)Density: 1.276 g/cm3; (17)Flash Point: 328.8 °C; (18)Enthalpy of Vaporization: 96.62 kJ/mol; (19)Boiling Point: 620.1 °C at 760 mmHg; (20)Vapour Pressure: 3.07E-16 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: O=C(O)[C@@H](NC(=O)OCC3c1ccccc1c2c3cccc2)Cc4ccccc4
(2)InChI: InChI=1/C24H21NO4/c26-23(27)22(14-16-8-2-1-3-9-16)25-24(28)29-15-21-19-12-6-4-10-17(19)18-11-5-7-13-20(18)21/h1-13,21-22H,14-15H2,(H,25,28)(H,26,27)/t22-/m0/s1
(3)InChIKey: SJVFAHZPLIXNDH-QFIPXVFZBJ