CAS No.16626-02-1,(S)-2-AMINO-3-(5-FLUORO-1H-INDOL-3-YL)-PROPIONIC ACID Suppliers

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Basic Information

Molecular Structure:
CAS No.:	16626-02-1
Name:	(S)-2-AMINO-3-(5-FLUORO-1H-INDOL-3-YL)-PROPIONIC ACID
Article Data:	12

Formula:	C₁₁H₁₁FN₂O₂
Molecular Weight:	222.219
Synonyms:	Tryptophan,5-fluoro-, L- (8CI);5-Fluoro-L-tryptophan;5-Fluorotryptophan;L-5-Fluorotryptophan;
Density:	1.442 g/cm³
Melting Point:	238-239 °C
Boiling Point:	450.7 °C at 760 mmHg
Flash Point:	226.4 °C
Safety:	22-24/25
PSA:	79.11000
LogP:	1.96170

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Specification

The L-Tryptophan, 5-fluoro- is an organic compound with the formula C₁₁H₁₁FN₂O₂. The systematic name of this chemical is 5-fluoro-L-tryptophan. With the CAS registry number 16626-02-1, it is also named as Tryptophan, 5-fluoro-, DL-. The product's categories are Indoles and Derivatives; FA - FLEnzyme Inhibitors; Substrate AnalogsPeptide Synthesis; Alphabetic; Enzyme Inhibitors by Type; F; Tryptophan Derivatives; Unnatural Amino Acid Derivatives.

Physical properties about L-Tryptophan, 5-fluoro- are: (1)ACD/LogP: 1.09; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 1; (5)ACD/KOC (pH 7.4): 1; (6)#H bond acceptors: 4; (7)#H bond donors: 4; (8)#Freely Rotating Bonds: 4; (9)Polar Surface Area: 34.47 Å²; (10)Index of Refraction: 1.673; (11)Molar Refractivity: 57.76 cm³; (12)Molar Volume: 154 cm³; (13)Polarizability: 22.89×10^-24cm³; (14)Surface Tension: 67.9 dyne/cm; (15)Density: 1.442 g/cm³; (16)Flash Point: 226.4 °C; (17)Enthalpy of Vaporization: 74.78 kJ/mol; (18)Boiling Point: 450.7 °C at 760 mmHg; (19)Vapour Pressure: 6.54E-09 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(O)[C@@H](N)Cc2c1cc(F)ccc1nc2
(2)InChI: InChI=1/C11H11FN2O2/c12-7-1-2-10-8(4-7)6(5-14-10)3-9(13)11(15)16/h1-2,4-5,9,14H,3,13H2,(H,15,16)/t9-/m0/s1
(3)InChIKey: INPQIVHQSQUEAJ-VIFPVBQEBE
(4)Std. InChI: InChI=1S/C11H11FN2O2/c12-7-1-2-10-8(4-7)6(5-14-10)3-9(13)11(15)16/h1-2,4-5,9,14H,3,13H2,(H,15,16)/t9-/m0/s1
(5)Std. InChIKey: INPQIVHQSQUEAJ-VIFPVBQESA-N