2-(9-Decenyl)phenanthrene
PubChem CID: 129682058
Connections displayed (default: 10).
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| Compound Synonyms | 2-(9-decenyl)phenanthrene |
|---|---|
| Topological Polar Surface Area | 0.0 |
| Hydrogen Bond Donor Count | 0.0 |
| Heavy Atom Count | 24.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 357.0 |
| Database Name | cmaup_ingredients;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | 2-dec-9-enylphenanthrene |
| Prediction Hob | 0.0 |
| Xlogp | 9.4 |
| Molecular Formula | C24H28 |
| Prediction Swissadme | 0.0 |
| Inchi Key | QCSSPUSNCHKEOS-UHFFFAOYSA-N |
| Fcsp3 | 0.3333333333333333 |
| Logs | -7.424 |
| Rotatable Bond Count | 9.0 |
| Logd | 5.126 |
| Compound Name | 2-(9-Decenyl)phenanthrene |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 316.219 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 316.219 |
| Hydrogen Bond Acceptor Count | 0.0 |
| Molecular Weight | 316.5 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | -7.379192266666666 |
| Inchi | InChI=1S/C24H28/c1-2-3-4-5-6-7-8-9-12-20-15-18-24-22(19-20)17-16-21-13-10-11-14-23(21)24/h2,10-11,13-19H,1,3-9,12H2 |
| Smiles | C=CCCCCCCCCC1=CC2=C(C=C1)C3=CC=CC=C3C=C2 |
| Nring | 3.0 |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Acacia Pruinosa (Plant) Rel Props:Source_db:cmaup_ingredients - 2. Outgoing r'ship
FOUND_INto/from Aegilops Geniculata (Plant) Rel Props:Source_db:cmaup_ingredients - 3. Outgoing r'ship
FOUND_INto/from Cycas Beddomei (Plant) Rel Props:Source_db:cmaup_ingredients - 4. Outgoing r'ship
FOUND_INto/from Iodes Cirrhosa (Plant) Rel Props:Source_db:cmaup_ingredients - 5. Outgoing r'ship
FOUND_INto/from Lespedeza Davidii (Plant) Rel Props:Source_db:cmaup_ingredients - 6. Outgoing r'ship
FOUND_INto/from Syzygium Samarangense (Plant) Rel Props:Source_db:cmaup_ingredients