IUPAC Name :2-[[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]amino]-3-(4-hydroxyphenyl)propanoic acid
InChI :InChI=1/C18H17NO6/c20-13-5-1-11(2-6-13)9-14(18(24)25)19-17(23)8-4-12-3-7-15(21)16(22)10-12/h1-8,10,14,20-22H,9H2,(H,19,23)(H,24,25)/b8-4+
Std.InChI: InChI=1S/C18H17NO6/c20-13-5-1-11(2-6-13)9-14(18(24)25)19-17(23)8-4-12-3-7-15(21)16(22)10-12/h1-8,10,14,20-22H,9H2,(H,19,23)(H,24,25)/b8-4+
InChIKey :JRXLVUMFJASLDR-XBXARRHUBA
Std.InChIKey: JRXLVUMFJASLDR-XBXARRHUSA-N
SMILES :C1=CC(=CC=C1CC(C(=O)O)NC(=O)/C=C/C2=CC(=C(C=C2)O)O)O
Molar Refractivity :88.56 ± 0.5 cm3 (est)
Parachor :693.5 ± 8.0 cm3 (est)
Index of Refraction :1.615 ± 0.05
(est)
Surface Tension :55.8 ± 7.0 dyne/cm (est)
Density :1.35 ± 0.1 g/cm3 (est)
Polarizability :35.11 ± 0.5 10-24cm3 (est)