3-[2-[(1R,4aβ)-2-Methylene-5α-(hydroxymethyl)-5,8aα-dimethyl-6α-hydroxydecalin-1α-yl]ethyl]-2,5-dihydrofuran-2-one
- Product Name3-[2-[(1R,4aβ)-2-Methylene-5α-(hydroxymethyl)-5,8aα-dimethyl-6α-hydroxydecalin-1α-yl]ethyl]-2,5-dihydrofuran-2-one
- CAS4176-97-0
- CBNumberCB32225909
- MFC20H30O4
- MW334.45
- EINECS2017-001-1
- MDL NumberMFCD01861504
- MOL File4176-97-0.mol
- MSDS FileSDS
Chemical Properties
| Melting point | 176-178℃ |
| Boiling point | 509.5±50.0 °C(Predicted) |
| Density | 1.15 |
| storage temp. | Store at -20°C |
| solubility | Acetonitrile: soluble |
| form | A solid |
| pka | 14.89±0.70(Predicted) |
| color | White to off-white |
| InChI | InChI=1S/C20H30O4/c1-13-4-7-16-19(2,10-8-17(22)20(16,3)12-21)15(13)6-5-14-9-11-24-18(14)23/h9,15-17,21-22H,1,4-8,10-12H2,2-3H3/t15-,16+,17-,19+,20+/m1/s1 |
| InChIKey | GVRNTWSGBWPJGS-YSDSKTICSA-N |
| SMILES | O1CC=C(CC[C@H]2[C@@]3(C)[C@@]([H])([C@@](CO)(C)[C@H](O)CC3)CCC2=C)C1=O |
| FDA UNII | WLN91FAQ6Z |
| UNSPSC Code | 41116107 |
| NACRES | NA.24 |