The Phenylalanine, b-phenyl-, with CAS registry number 62653-26-3, has the systematic name of β-phenylphenylalanine. Besides this, it is also called 2-Amino-3,3-diphenyl-propionic acid. This chemical should stored at the room temperature. And the chemical formula of this chemical is C15H15NO2.
Physical properties of Phenylalanine, b-phenyl-: (1)ACD/LogP: 2.86; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.36; (4)ACD/LogD (pH 7.4): 0.34; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 2.72; (8)ACD/KOC (pH 7.4): 2.61; (9)#H bond acceptors: 3; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 5; (12)Polar Surface Area: 29.54 Å2; (13)Index of Refraction: 1.611; (14)Molar Refractivity: 69.89 cm3; (15)Molar Volume: 201.2 cm3; (16)Polarizability: 27.7×10-24cm3; (17)Surface Tension: 53.6 dyne/cm; (18)Density: 1.198 g/cm3; (19)Flash Point: 189.2 °C; (20)Enthalpy of Vaporization: 67.35 kJ/mol; (21)Boiling Point: 389.2 °C at 760 mmHg; (22)Vapour Pressure: 9.35E-07 mmHg at 25°C.
Preparation: this chemical can be prepared by 5-benzhydryl-imidazolidine-2,4-dione. This reaction will need reagents NaOH, hydrochloric acid and solvent H2O. The reaction time is 18 hour(s). The yield is about 99%.
You can still convert the following datas into molecular structure:
(1)SMILES: O=C(O)C(N)C(c1ccccc1)c2ccccc2
(2)InChI: InChI=1/C15H15NO2/c16-14(15(17)18)13(11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10,13-14H,16H2,(H,17,18)
(3)InChIKey: PECGVEGMRUZOML-UHFFFAOYAU
(4)Std. InChI: InChI=1S/C15H15NO2/c16-14(15(17)18)13(11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10,13-14H,16H2,(H,17,18)
(5)Std. InChIKey: PECGVEGMRUZOML-UHFFFAOYSA-N
About|Contact|Cas|Product Name|Molecular|Country|Encyclopedia
Message|New Cas|MSDS|Service|Advertisement|CAS DataBase|Article Data|Manufacturers | Chemical Catalog
©2008 LookChem.com,License: ICP
NO.:Zhejiang16009103
complaints:service@lookchem.com Desktop View