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Fmoc-D-phenylalanine

  • Name Fmoc-D-phenylalanine
  • EINECS1533716-785-6
  • CAS No. 86123-10-6
  • Density1.276 g/cm3
  • PSA75.63000
  • LogP4.61190
  • SolubilityN/A
  • Melting Point181-185 °C
  • FormulaC24H21NO4
  • Boiling Point620.1 °C at 760 mmHg
  • Molecular Weight387.435
  • Flash Point328.8 °C
  • Transport InformationN/A
  • Appearancewhite powder
  • Safety22-24/25
  • Risk CodesN/A
  • Molecular Structure
    Molecular Structure of 86123-10-6 (Fmoc-D-phenylalanine)
  • Hazard SymbolsN/A
  • SynonymsN/A
  • Article Data12

Fmoc-D-phenylalanine Specification

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

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