1-Methyl-4-(1-propenyl)cyclohexane
PubChem CID: 5319687
Connections displayed (default: 10).
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| Compound Synonyms | 1-methyl-4-(1-propenyl)cyclohexane |
|---|---|
| Topological Polar Surface Area | 0.0 |
| Hydrogen Bond Donor Count | 0.0 |
| Heavy Atom Count | 10.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 105.0 |
| Database Name | cmaup_ingredients;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | 1-methyl-4-[(E)-prop-1-enyl]cyclohexane |
| Prediction Hob | 1.0 |
| Xlogp | 4.1 |
| Molecular Formula | C10H18 |
| Prediction Swissadme | 0.0 |
| Inchi Key | YDFSNGYYRPSYIJ-ONEGZZNKSA-N |
| Fcsp3 | 0.8 |
| Logs | -4.731 |
| Rotatable Bond Count | 1.0 |
| Logd | 4.263 |
| Compound Name | 1-Methyl-4-(1-propenyl)cyclohexane |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 138.141 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 138.141 |
| Hydrogen Bond Acceptor Count | 0.0 |
| Molecular Weight | 138.25 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 1.0 |
| Esol | -3.2078748 |
| Inchi | InChI=1S/C10H18/c1-3-4-10-7-5-9(2)6-8-10/h3-4,9-10H,5-8H2,1-2H3/b4-3+ |
| Smiles | C/C=C/C1CCC(CC1)C |
| Nring | 1.0 |
| Defined Bond Stereocenter Count | 1.0 |
- 1. Outgoing r'ship
FOUND_INto/from Cistanche Deserticola (Plant) Rel Props:Source_db:cmaup_ingredients - 2. Outgoing r'ship
FOUND_INto/from Panax Notoginseng (Plant) Rel Props:Source_db:cmaup_ingredients - 3. Outgoing r'ship
FOUND_INto/from Panax Pseudo (Plant) Rel Props:Reference: - 4. Outgoing r'ship
FOUND_INto/from Panax Pseudo-Ginseng (Plant) Rel Props:Source_db:cmaup_ingredients