3-Fluoro-D-phenylalanine supplier

Name
3-FLUORO-D-PHENYLALANINE
EINECS 220-104-1
CAS No. 110117-84-5
Article Data14
CAS DataBase
Density 1.293g/cm³
Solubility
Melting Point
Formula C₉H₁₀FNO₂
Boiling Point 305 °C at 760 mmHg
Molecular Weight 183.182
Flash Point 138.3 °C
Transport Information
Appearance
Safety 22-24/25
Risk Codes
Molecular Structure
Hazard Symbols Xi
Synonyms 3-Fluoro-D-phenylalanine;D-3-Fluorophenylalanine;D-m-Fluorophenylalanine;m-Fluoro-D-phenylalanine;
PSA 63.32000
LogP 1.48040

3-Fluoro-D-phenylalanine Specification

The D-Phenylalanine,3-fluoro-, with CAS registry number 110117-84-5, belongs to the following product categories: (1)Amino Acids; (2)A-amino. It has the systematic name of 3-fluoro-D-phenylalanine. This chemical should be stored at the temperature of 0-5°C. When use this chemical, please do not breathe dust and avoid contact with skin and eyes.

Physical properties of D-Phenylalanine,3-fluoro-: (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)Enthalpy of Vaporization: 57.6 kJ/mol; (17)Vapour Pressure: 0.000369 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Fc1cc(ccc1)C[C@H](C(=O)O)N
(2)InChI: InChI=1/C9H10FNO2/c10-7-3-1-2-6(4-7)5-8(11)9(12)13/h1-4,8H,5,11H2,(H,12,13)/t8-/m1/s1
(3)InChIKey: VWHRYODZTDMVSS-MRVPVSSYBU
(4)Std. InChI: InChI=1S/C9H10FNO2/c10-7-3-1-2-6(4-7)5-8(11)9(12)13/h1-4,8H,5,11H2,(H,12,13)/t8-/m1/s1
(5)Std. InChIKey: VWHRYODZTDMVSS-MRVPVSSYSA-N

Product Name

3-FLUORO-D-PHENYLALANINE

3-Fluoro-D-phenylalanine Specification

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