Albizziin

The L-Alanine,3-[(aminocarbonyl)amino]-, with the CAS registry number 1483-07-4, is also known as L-2-Amino-3-ureidopropionic acid. It belongs to the product categories of Acids 13C, 2H, 15N; Amino Acids & Derivatives; Inhibitors; Herpes Viruses. Its EINECS registry number is 216-046-1. This chemical's molecular formula is C₄H₉N₃O₃ and molecular weight is 147.13. What's more, its IUPAC name is called (2S)-2-Amino-3-(carbamoylamino)propanoic acid. This chemical is hite powder. And it is a glutamase inhibitor, a glutaminyl-tRNA synthetase inhibitor as well as an intermediate in the synthesis of heterocycles. It is also a potential effector group in affinity chromatography. It should be kept in a cool, dry and ventilated warehouse.

Physical properties about L-Alanine,3-[(aminocarbonyl)amino]- are: (1) ACD/LogP: -1.50; (2) # of Rule of 5 Violations: 1; (3) ACD/LogD (pH 5.5): -4; (4) ACD/LogD (pH 7.4): -4.01; (5) ACD/BCF (pH 5.5): 1; (6) ACD/BCF (pH 7.4): 1; (7) ACD/KOC (pH 5.5): 1; (8) ACD/KOC (pH 7.4): 1; (9) #H bond acceptors: 6; (10) #H bond donors: 6; (11) #Freely Rotating Bonds: 4; (12) Polar Surface Area: 53.09 Å²; (13) Index of Refraction: 1.55; (14) Molar Refractivity: 32.79 cm³; (15) Molar Volume: 102.8 cm³; (16) Surface Tension: 73.8 dyne/cm; (17) Density: 1.43 g/cm³; (18) Flash Point: 171 °C; (19) Enthalpy of Vaporization: 66.42 kJ/mol; (20) Boiling Point: 359.1 °C at 760 mmHg; (21) Vapour Pressure: 3.95E-06 mmHg at 25 °C; (22) Melting Point: 217 °C.

When you are dealing with this chemical, you should be very careful. This chemical is irritating to eyes, respiratory system, skin and may cause inflammation to the skin or other mucous membranes. Therefore, you should wear suitable protective clothing. And in case of contacting with eyes, you should rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1) SMILES: O=C(O)[C@@H](N)CNC(=O)N
(2) InChI: InChI=1/C4H9N3O3/c5-2(3(8)9)1-7-4(6)10/h2H,1,5H2,(H,8,9)(H3,6,7,10)/t2-/m0/s1
(3) InChIKey: GZYFIMLSHBLMKF-REOHCLBHBM