7,7-dimethyl-4-(thiophen-3-yl)-4,6,7,8-tetrahydro-2H-1-benzopyran-2,5(3H)-dione
Chemical Structure Depiction of
7,7-dimethyl-4-(thiophen-3-yl)-4,6,7,8-tetrahydro-2H-1-benzopyran-2,5(3H)-dione
7,7-dimethyl-4-(thiophen-3-yl)-4,6,7,8-tetrahydro-2H-1-benzopyran-2,5(3H)-dione
Compound characteristics
| Compound ID: | 8015-8067 |
| Compound Name: | 7,7-dimethyl-4-(thiophen-3-yl)-4,6,7,8-tetrahydro-2H-1-benzopyran-2,5(3H)-dione |
| Molecular Weight: | 276.35 |
| Molecular Formula: | C15 H16 O3 S |
| Smiles: | CC1(C)CC2=C(C(CC(=O)O2)c2ccsc2)C(C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.4478 |
| logD: | 2.4478 |
| logSw: | -2.6469 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 34.701 |
| InChI Key: | NBXDBRKEEFBECV-JTQLQIEISA-N |