| Melting point |
168-170 °C(lit.) |
| Boiling point |
407.89°C (rough estimate) |
| Density |
1.0998 (rough estimate) |
| vapor pressure |
0Pa at 20℃ |
| refractive index |
1.5192 (estimate) |
| storage temp. |
Refrigerator |
| solubility |
Chloroform, DMSO (Slightly), Methanol (Slightly) |
| form |
Solid |
| color |
White to Off-White |
| optical activity |
[α]20/D +2.4°, c = 2 in ethanol |
| Water Solubility |
11.5mg/L(temperature not stated) |
| InChI |
InChI=1/C21H30O3/c1-13(22)24-15-8-10-20(2)14(12-15)4-5-16-17-6-7-19(23)21(17,3)11-9-18(16)20/h4,15-18H,5-12H2,1-3H3/t15-,16-,17-,18-,20-,21-/s3 |
| InChIKey |
NCMZQTLCXHGLOK-KJBVPOJVSA-N |
| SMILES |
C[C@]12CC[C@H](OC(=O)C)CC1=CC[C@@]1([H])[C@]3([H])CCC(=O)[C@@]3(C)CC[C@]21[H] |&1:1,4,13,15,21,25,r| |
| LogP |
5.1 at 20℃ |
| CAS DataBase Reference |
853-23-6 |