(3,5-di-tert-butyl-4-oxocyclohexa-2,5-dien-1-ylidene)acetonitrile
Chemical Structure Depiction of
(3,5-di-tert-butyl-4-oxocyclohexa-2,5-dien-1-ylidene)acetonitrile
(3,5-di-tert-butyl-4-oxocyclohexa-2,5-dien-1-ylidene)acetonitrile
Compound characteristics
| Compound ID: | 8004-7033 |
| Compound Name: | (3,5-di-tert-butyl-4-oxocyclohexa-2,5-dien-1-ylidene)acetonitrile |
| Molecular Weight: | 243.35 |
| Molecular Formula: | C16 H21 N O |
| Smiles: | CC(C)(C)C1=CC(=CC#N)C=C(C1=O)C(C)(C)C |
| Stereo: | ACHIRAL |
| logP: | 4.6887 |
| logD: | 4.6887 |
| logSw: | -4.339 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 31.0688 |
| InChI Key: | VWJMHEHVAHYPDI-UHFFFAOYSA-N |