1261254-48-1
| Name | 17β-Estradiol-[2,3,4-13C3] |
| CAS | 1261254-48-1 |
| EINECS(EC#) | 694-116-4 |
| Molecular Formula | C18H24O2 |
| MDL Number | MFCD15144881 |
| Molecular Weight | 275.409 |
| MOL File | 1261254-48-1.mol |
Chemical Properties
| Melting point | 178-179°C (lit.) |
| density | 1.171±0.06 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted) |
| Fp | 2℃ |
| storage temp. | -20°C |
| form | liquid |
| Major Application | clinical testing |
| InChI | 1S/C18H24O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h3,5,10,14-17,19-20H,2,4,6-9H2,1H3/t14-,15-,16+,17+,18+/m1/s1/i3+1,10+1,12+1 |
| InChIKey | VOXZDWNPVJITMN-CLMZCXLCSA-N |
| SMILES | C[C@]12CC[C@H]3[C@@H](CCc4[13cH][13c](O)[13cH]cc34)[C@@H]1CC[C@@H]2O |
Safety Data
| Hazard Codes | F,Xn,T |
| Risk Statements | |
| Safety Statements | |
| RIDADR | UN 1648 3 / PGII |
| WGK Germany | 3 |
| Storage Class | 3 - Flammable liquids |
| Hazard Classifications | Acute Tox. 4 Dermal Acute Tox. 4 Inhalation Acute Tox. 4 Oral Carc. 2 Eye Irrit. 2 Flam. Liq. 2 Lact. Repr. 1A |