2,6,11,15-Tetramethylhexadeca-2,6,8,10,14-pentaene
PubChem CID: 549768
Connections displayed (default: 10).
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| Topological Polar Surface Area | 0.0 |
|---|---|
| Hydrogen Bond Donor Count | 0.0 |
| Heavy Atom Count | 20.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 363.0 |
| Database Name | cmaup_ingredients;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | 2,6,11,15-tetramethylhexadeca-2,6,8,10,14-pentaene |
| Prediction Hob | 1.0 |
| Xlogp | 7.9 |
| Molecular Formula | C20H32 |
| Prediction Swissadme | 0.0 |
| Inchi Key | ZUXCVSSOFQSXFF-UHFFFAOYSA-N |
| Fcsp3 | 0.5 |
| Logs | -5.872 |
| Rotatable Bond Count | 8.0 |
| Logd | 4.883 |
| Compound Name | 2,6,11,15-Tetramethylhexadeca-2,6,8,10,14-pentaene |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 272.25 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 272.25 |
| Hydrogen Bond Acceptor Count | 0.0 |
| Molecular Weight | 272.5 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 3.0 |
| Esol | -5.9909512 |
| Inchi | InChI=1S/C20H32/c1-17(2)11-9-15-19(5)13-7-8-14-20(6)16-10-12-18(3)4/h7-8,11-14H,9-10,15-16H2,1-6H3 |
| Smiles | CC(=CCCC(=CC=CC=C(C)CCC=C(C)C)C)C |
| Nring | 0.0 |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Citrus Maxima (Plant) Rel Props:Source_db:cmaup_ingredients