The 3-(N-Ethanolamino)-L-alanine, with cas registry number 848396-10-1, belongs to the following product categories: Amino Acids. It has the systematic name of 3-(1H-imidazol-1-yl)-D-alanine. And it is also called D-alanine, 3-(1H-imidazol-1-yl)-.
Physical properties about this chemical are: (1)# of Rule of 5 Violations: 0; (2)#H bond acceptors: 5; (3)#H bond donors: 3; (4)#Freely Rotating Bonds: 4; (5)Polar Surface Area: 81.14 Å2; (6)Index of Refraction: 1.631; (7)Molar Refractivity: 38.27 cm3; (8)Molar Volume: 107.3 cm3; (9)Polarizability: 15.17×10-24cm3; (10)Surface Tension: 63.9 dyne/cm; (11)Enthalpy of Vaporization: 70.71 kJ/mol; (12)Vapour Pressure: 1.04E-07 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: c1cn(cn1)CC(C(=O)O)N
(2)InChI: InChI=1/C6H9N3O2/c7-5(6(10)11)3-9-2-1-8-4-9/h1-2,4-5H,3,7H2,(H,10,11)/t5-/m1/s1
(3)InChIKey: FWBXNMSLCRNZOV-RXMQYKEDBM
(4)Std. InChI: InChI=1S/C6H9N3O2/c7-5(6(10)11)3-9-2-1-8-4-9/h1-2,4-5H,3,7H2,(H,10,11)/t5-/m1/s1
(5)Std. InChIKey: FWBXNMSLCRNZOV-RXMQYKEDSA-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