Undecylenoyl phenylalanine
Bezeichnung:Undecylenoyl phenylalanine
CAS-Nr175357-18-3
Englisch Name:Undecylenoyl phenylalanine
CBNumberCB1965399
SummenformelC20H29NO3
Molgewicht331.45
MOL-Datei175357-18-3.mol
Undecylenoyl phenylalanine physikalisch-chemischer Eigenschaften
Schmelzpunkt | 109-112 °C |
Siedepunkt | 540.0±50.0 °C(Predicted) |
Dichte | 1.047±0.06 g/cm3(Predicted) |
Dampfdruck | 0-0Pa at 25-60℃ |
pka | 3.63±0.10(Predicted) |
InChI | InChI=1S/C20H29NO3/c1-2-3-4-5-6-7-8-12-15-19(22)21-18(20(23)24)16-17-13-10-9-11-14-17/h2,9-11,13-14,18H,1,3-8,12,15-16H2,(H,21,22)(H,23,24)/t18-/m0/s1 |
InChIKey | RTBWWWVNZWFNBV-SFHVURJKSA-N |
SMILES | C(O)(=O)[C@H](CC1=CC=CC=C1)NC(=O)CCCCCCCCC=C |
LogP | -0.04-3.3 at pH2-7 |