Chemical Properties
Boiling point | 488.1±45.0 °C(Predicted) |
Density | 1.008±0.06 g/cm3(Predicted) |
storage temp. | -80°C |
solubility | DMF: 50 mg/ml; DMSO: 60 mg/ml; DMSO:PBS (pH 7.2) (1:3): 0.25 mg/ml; Ethanol: 35 mg/ml |
form | A solution in acetonitrile |
pka | 9.63±0.45(Predicted) |
InChI | InChI=1S/C23H34O2/c1-5-6-7-8-9-10-18-14-21(24)23(22(25)15-18)20-13-17(4)11-12-19(20)16(2)3/h13-15,19-20,24-25H,2,5-12H2,1,3-4H3/t19-,20+/m0/s1 |
InChIKey | GGHRHCGOMWNLCE-VQTJNVASSA-N |
SMILES | C1(O)=CC(CCCCCCC)=CC(O)=C1[C@H]1[C@H](C(C)=C)CCC(C)=C1 |