(3Z)-3-(oxolan-3-ylidene)oxolan-2-one
Formula:C8H10O3
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(3Z)-3-(oxolan-3-ylidene)oxolan-2-one is a drug-like molecule.
| MolName | (3Z)-3-(oxolan-3-ylidene)oxolan-2-one |
| MolecularFormula | C8H10O3 |
| Smiles | O=C1OCC/C1=C1/COCC1 |
| InChI | InChI=1S/C8H10O3/c9-8-7(2-4-11-8)6-1-3-10-5-6/h1-5H2 |
| InChIK | YHKVAQGJEMAZMW-UHFFFAOYSA-N |
| TotalMolweight | 154.164 |
| Molweight | 154.164 |
| MonoisotopicMass | 154.062995 |
| CLogP | 0.1536 |
| CLogS | -1 |
| H Acceptors | 3 |
| TotalSurfaceArea | 115.97 |
| Relative PSA | 0.2849 |
| PolarSurfaceArea | 35.53 |
| Druglikeness | -1.4207 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.54545 |
| Fragments | 1 |
| Non HAtoms | 11 |
| NonCHAtoms | 3 |
| Electronegative Atoms | 3 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Sp3Atoms | 7 |
| StereoCon |
Click to Load Molecule:
1 - (3Z)-3-(oxolan-3-ylidene)oxolan-2-one | 2 - (3Z)-3-(oxolan-3-ylidene)oxolan-2-one
Spacefill |
Wire |
Ball & Stick |
Iso-vdw |
Opaque |
Dot Surface |
Mep |
Translucent |
Spin |
Label On |
Off