1,1'-Vinylidenebiscyclopropane
PubChem CID: 69977
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| Compound Synonyms | 1,1-Dicyclopropylethylene, 822-93-5, Cyclopropane, 1,1'-ethenylidenebis-, 1,1'-Vinylidenebiscyclopropane, Ethylene, 1,1-dicyclopropyl-, 1-cyclopropylethenylcyclopropane, (1-cyclopropylethenyl)cyclopropane, WTV4P2RB2J, EINECS 212-508-1, DTXSID90231624, 1,1'-ETHENYLIDENEBIS(CYCLOPROPANE), 1,1'-Ethenylidenebis[cyclopropane], 1,1-Dicyclopropylethene, UNII-WTV4P2RB2J, ethene-1,1-diyldicyclopropane, (1-Cyclopropylvinyl)cyclopropane, 1,1'-Ethenylidenebiscyclopropane, DTXCID20154115, (1-Cyclopropylvinyl)cyclopropane #, AKOS006283297, NS00038185, EN300-155145, InChI=1/C8H12/c1-6(7-2-3-7)8-4-5-8/h7-8H,1-5H, 212-508-1 |
|---|---|
| Ghose Rule | False |
| Classyfire Kingdom | Organic compounds |
| Topological Polar Surface Area | 0.0 |
| Hydrogen Bond Donor Count | 0.0 |
| Pfizer 3 75 Rule | False |
| Scaffold Graph Level | CC(C1CC1)C1CC1 |
| Deep Smiles | C=CCCC3)))CCC3 |
| Heavy Atom Count | 8.0 |
| Classyfire Class | Unsaturated hydrocarbons |
| Scaffold Graph Node Level | CC(C1CC1)C1CC1 |
| Classyfire Subclass | Branched unsaturated hydrocarbons |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 102.0 |
| Database Name | imppat_phytochem;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | 1-cyclopropylethenylcyclopropane |
| Veber Rule | True |
| Classyfire Superclass | Hydrocarbons |
| Xlogp | 3.1 |
| Gsk 4 400 Rule | True |
| Molecular Formula | C8H12 |
| Scaffold Graph Node Bond Level | C=C(C1CC1)C1CC1 |
| Inchi Key | RXCSODBXHNSSCQ-UHFFFAOYSA-N |
| Silicos It Class | Soluble |
| Rotatable Bond Count | 2.0 |
| Synonyms | 1,1-dicyclopropylethylene |
| Esol Class | Soluble |
| Functional Groups | C=C(C)C |
| Compound Name | 1,1'-Vinylidenebiscyclopropane |
| Exact Mass | 108.094 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 108.094 |
| Hydrogen Bond Acceptor Count | 0.0 |
| Molecular Weight | 108.18 |
| Gi Absorption | False |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 0.0 |
| Lipinski Rule Of 5 | True |
| Inchi | InChI=1S/C8H12/c1-6(7-2-3-7)8-4-5-8/h7-8H,1-5H2 |
| Smiles | C=C(C1CC1)C2CC2 |
| Defined Bond Stereocenter Count | 0.0 |
| Egan Rule | True |
- 1. Outgoing r'ship
FOUND_INto/from Zingiber Officinale (Plant) Rel Props:Reference:https://doi.org/10.1080/0972060x.2019.1611484