3-Oxopregn-4-ene-20-carbaldehyde
- Product Name3-Oxopregn-4-ene-20-carbaldehyde
- CAS24254-01-1
- CBNumberCB02418429
- MFC22H32O2
- MW328.49
- MOL File24254-01-1.mol
Chemical Properties
| Melting point | 156-160 °C |
| Boiling point | 459.4±14.0 °C(Predicted) |
| Density | 1.07±0.1 g/cm3(Predicted) |
| InChI | InChI=1S/C22H32O2/c1-14(13-23)18-6-7-19-17-5-4-15-12-16(24)8-10-21(15,2)20(17)9-11-22(18,19)3/h12-14,17-20H,4-11H2,1-3H3/t14?,17-,18+,19-,20-,21-,22+/m0/s1 |
| InChIKey | XVPJEGGIGJLDQK-ZRFCQXGJSA-N |
| SMILES | C1(=O)C=C2[C@](C)(CC1)[C@]1([H])[C@]([H])([C@@]3([H])[C@@](CC1)(C)[C@@H](C(C=O)C)CC3)CC2 |
| FDA UNII | 5EQD2A2KM6 |
| EPA Substance Registry System | 20-Formylpregn-4-en-3-one (24254-01-1) |
