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CAS No.: | 19883-78-4 |
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Name: | 2-FLUORO-L-PHENYLALANINE |
Article Data: | 18 |
Molecular Structure: | |
Formula: | C14H18INO4 |
Molecular Weight: | 183.182 |
Synonyms: | Alanine,3-(o-fluorophenyl)-, L- (8CI);2-Fluoro-L-phenylalanine;L-2-Fluorophenylalanine;o-Fluoro-L-phenylalanine;2-fluoro-L-phenylalanine;(2S)-2-amino-3-(2-fluorophenyl)propanoic acid;2-fluor-l-phenylalanin;2-Fluoro-L-phenylalanine;L-phenylalanine, 2-fluoro-; |
EINECS: | 220-105-7 |
Density: | 1.293 g/cm3 |
Melting Point: | 208-210 °C |
Boiling Point: | 308.1 °C at 760 mmHg |
Flash Point: | 140.1 °C |
Risk Codes: | 36/37/38 |
Safety: | 22-24/25 |
PSA: | 63.32000 |
LogP: | 1.48040 |
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The L-2-Fluorophenylalanine, with the CAS registry number 19883-78-4, has the systematic name and systematic name of 2-fluoro-L-phenylalanine. And the molecular formula of this chemical is C14H18INO4. It belongs to the following product categories: Amino Acids; Phenylalanine analogs and other aromatic alpha amino acids; Chiral Reagent; Peptide; a-amino; Non-natural amino acids. What's more, it should be stored at 0-5 °C. In addition, while dealing with this chemical, you should not breathe dust and then try to avoid contacting with skin and eyes.
The physical properties of L-2-Fluorophenylalanine are as following: (1)ACD/LogP: 1.17; (2)# of Rule of 5 Violations: 0; (3)ACD/BCF (pH 5.5): 1; (4)ACD/BCF (pH 7.4): 1; (5)ACD/KOC (pH 5.5): 1; (6)ACD/KOC (pH 7.4): 1; (7)#H bond acceptors: 3; (8)#H bond donors: 3; (9)#Freely Rotating Bonds: 4; (10)Polar Surface Area: 29.54 Å2; (11)Index of Refraction: 1.555; (12)Molar Refractivity: 45.48 cm3; (13)Molar Volume: 141.6 cm3; (14)Polarizability: 18.03×10-24cm3; (15)Surface Tension: 51.2 dyne/cm; (16)Density: 1.293 g/cm3; (17)Flash Point: 140.1 °C; (18)Enthalpy of Vaporization: 57.94 kJ/mol; (19)Boiling Point: 308.1 °C at 760 mmHg; (20)Vapour Pressure: 0.000301 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Fc1ccccc1C[C@@H](C(=O)O)N
(2)InChI: InChI=1/C9H10FNO2/c10-7-4-2-1-3-6(7)5-8(11)9(12)13/h1-4,8H,5,11H2,(H,12,13)/t8-/m0/s1
(3)InChIKey: NYCRCTMDYITATC-QMMMGPOBBW