1,3-Dicyclopentylcyclopentane
PubChem CID: 138647
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| Compound Synonyms | 1,3-Dicyclopentylcyclopentane, 1,1':3',1''-Tercyclopentane, 6051-40-7, Cyclopentane, 1,3-dicyclopentyl-, NSC 174947, 1,1''-Tercyclopentane, NSC174947, Cyclopentane,3-dicyclopentyl-, 1,3-dicyclopentyl-cyclopentane, DTXSID00975926, NSC-174947, 1~1~,2~1~:2~3~,3~1~-Tercyclopentane |
|---|---|
| Topological Polar Surface Area | 0.0 |
| Hydrogen Bond Donor Count | 0.0 |
| Heavy Atom Count | 15.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 174.0 |
| Database Name | cmaup_ingredients;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | 1,3-dicyclopentylcyclopentane |
| Prediction Hob | 1.0 |
| Xlogp | 6.5 |
| Molecular Formula | C15H26 |
| Prediction Swissadme | 0.0 |
| Inchi Key | VUIQTOLVCLYLAF-UHFFFAOYSA-N |
| Fcsp3 | 1.0 |
| Logs | -6.615 |
| Rotatable Bond Count | 2.0 |
| Logd | 4.615 |
| Compound Name | 1,3-Dicyclopentylcyclopentane |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 206.203 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 206.203 |
| Hydrogen Bond Acceptor Count | 0.0 |
| Molecular Weight | 206.37 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 2.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | -5.1014126 |
| Inchi | InChI=1S/C15H26/c1-2-6-12(5-1)14-9-10-15(11-14)13-7-3-4-8-13/h12-15H,1-11H2 |
| Smiles | C1CCC(C1)C2CCC(C2)C3CCCC3 |
| Nring | 3.0 |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Curcuma Longa (Plant) Rel Props:Source_db:cmaup_ingredients