IUPAC Name :(2S)-2-(3-acetamidopropanoylamino)-3-(1H-imidazol-5-yl)propanoic acid
InChI :InChI=1/C11H16N4O4/c1-7(16)13-3-2-10(17)15-9(11(18)19)4-8-5-12-6-14-8/h5-6,9H,2-4H2,1H3,(H,12,14)(H,13,16)(H,15,17)(H,18,19)/t9-/m0/s1
Std.InChI: InChI=1S/C11H16N4O4/c1-7(16)13-3-2-10(17)15-9(11(18)19)4-8-5-12-6-14-8/h5-6,9H,2-4H2,1H3,(H,12,14)(H,13,16)(H,15,17)(H,18,19)/t9-/m0/s1
InChIKey :BKAYIFDRRZZKNF-VIFPVBQEBE
Std.InChIKey: BKAYIFDRRZZKNF-VIFPVBQESA-N
SMILES :CC(=O)NCCC(=O)N[C@@H](CC1=CN=CN1)C(=O)O
MDL: MFCD04039376
Molar Refractivity :66.12 ± 0.5 cm3 (est)
Parachor :518.4 ± 8.0 cm3 (est)
Index of Refraction :1.619 ± 0.05
(est)
Surface Tension :57.4 ± 7.0 dyne/cm (est)
Density :1.42 ± 0.1 g/cm3 (est)
Polarizability :26.21 ± 0.5 10-24cm3 (est)