| Melting point |
149-151 °C(Solv: acetone (67-64-1); hexane (110-54-3)) |
| Boiling point |
464.4±45.0 °C(Predicted) |
| Density |
1.20±0.1 g/cm3(Predicted) |
| solubility |
Acetonitrile: 1 mg/ml; Ethanol: 1 mg/ml; Methanol: 1 mg/ml |
| form |
A crystalline solid |
| pka |
15.05±0.70(Predicted) |
| InChI |
InChI=1/C20H27ClO2/c1-18-9-8-16(22)17(21)15(18)5-4-12-13(18)6-10-19(2)14(12)7-11-20(19,3)23/h8-9,12-14,23H,4-7,10-11H2,1-3H3/t12-,13+,14+,18-,19+,20+/s3 |
| InChIKey |
AGUNEISBPXQOPA-RFNNMYDSNA-N |
| SMILES |
C[C@]12C=CC(=O)C(Cl)=C1CC[C@@]1([H])[C@]3([H])CC[C@@](O)(C)[C@@]3(C)CC[C@]21[H] |&1:1,11,13,17,20,24,r| |
