4-iodopentacyclo[6.6.6.0~2,7~.0~9,14~.0~15,20~]icosa-2,4,6,9,11,13,15,17,19-nonaene
Chemical Structure Depiction of
4-iodopentacyclo[6.6.6.0~2,7~.0~9,14~.0~15,20~]icosa-2,4,6,9,11,13,15,17,19-nonaene
4-iodopentacyclo[6.6.6.0~2,7~.0~9,14~.0~15,20~]icosa-2,4,6,9,11,13,15,17,19-nonaene
Compound characteristics
| Compound ID: | 0087-0023 |
| Compound Name: | 4-iodopentacyclo[6.6.6.0~2,7~.0~9,14~.0~15,20~]icosa-2,4,6,9,11,13,15,17,19-nonaene |
| Molecular Weight: | 380.23 |
| Molecular Formula: | C20 H13 I |
| Smiles: | c1ccc2C3c4ccccc4C(c2c1)c1ccc(cc13)I |
| Stereo: | ACHIRAL |
| logP: | 7.0043 |
| logD: | 7.0043 |
| logSw: | -6.5078 |
| InChI Key: | TXVOTIBVFDWCJW-UHFFFAOYSA-N |