4,4,6,6-Tetramethylbicyclo[3.1.0]hex-2-ene
PubChem CID: 578424
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| Compound Synonyms | 4,4,6,6-Tetramethylbicyclo[3.1.0]hex-2-ene, 19487-09-3, Bicyclo[3.1.0]hex-2-ene, 4,4,6,6-tetramethyl-, DTXSID80342071, VADWNFZKNBIGHP-UHFFFAOYSA-N, 4,4,6,6-tetramethyl-bicyclo [3,1,0]hex-2-ene, 4,4,6,6-Tetramethylbicyclo[3.1.0]hex-2-ene # |
|---|---|
| Topological Polar Surface Area | 0.0 |
| Hydrogen Bond Donor Count | 0.0 |
| Heavy Atom Count | 10.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 196.0 |
| Database Name | cmaup_ingredients;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | 4,4,6,6-tetramethylbicyclo[3.1.0]hex-2-ene |
| Prediction Hob | 1.0 |
| Xlogp | 3.3 |
| Molecular Formula | C10H16 |
| Prediction Swissadme | 0.0 |
| Inchi Key | VADWNFZKNBIGHP-UHFFFAOYSA-N |
| Fcsp3 | 0.8 |
| Logs | -4.809 |
| Rotatable Bond Count | 0.0 |
| Logd | 3.966 |
| Compound Name | 4,4,6,6-Tetramethylbicyclo[3.1.0]hex-2-ene |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 136.125 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 136.125 |
| Hydrogen Bond Acceptor Count | 0.0 |
| Molecular Weight | 136.23 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 2.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | -2.7447755999999996 |
| Inchi | InChI=1S/C10H16/c1-9(2)6-5-7-8(9)10(7,3)4/h5-8H,1-4H3 |
| Smiles | CC1(C=CC2C1C2(C)C)C |
| Nring | 2.0 |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Houttuynia Cordata (Plant) Rel Props:Source_db:cmaup_ingredients