1-Isopropyl-4-methylenecyclohexane
PubChem CID: 517973
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| Compound Synonyms | 1-isopropyl-4-methylenecyclohexane, 1(7)-p-Menthene, 4-isopropyl-1-methylenecyclohexane, 1-methylidene-4-propan-2-ylcyclohexane, 1-(1-methylethyl)-4-methylenecyclohexane, CHEBI:59156, 1124-24-9, 4-methylene-1-(propan-2-yl)cyclohexane, Epitope ID:123901, DTXSID70892353, CEWQMRMCIKPUIK-UHFFFAOYSA-N, AKOS011393604, 1-methylene-4-(1-methylethyl)cyclohexane, 1-methylidene-4-(propan-2-yl)cyclohexane, Q27126498 |
|---|---|
| Topological Polar Surface Area | 0.0 |
| Hydrogen Bond Donor Count | 0.0 |
| Heavy Atom Count | 10.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 112.0 |
| Database Name | cmaup_ingredients;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | 1-methylidene-4-propan-2-ylcyclohexane |
| Prediction Hob | 1.0 |
| Xlogp | 3.7 |
| Molecular Formula | C10H18 |
| Prediction Swissadme | 0.0 |
| Inchi Key | CEWQMRMCIKPUIK-UHFFFAOYSA-N |
| Fcsp3 | 0.8 |
| Logs | -4.02 |
| Rotatable Bond Count | 1.0 |
| Logd | 3.675 |
| Compound Name | 1-Isopropyl-4-methylenecyclohexane |
| 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 | 0.0 |
| Esol | -2.9369747999999998 |
| Inchi | InChI=1S/C10H18/c1-8(2)10-6-4-9(3)5-7-10/h8,10H,3-7H2,1-2H3 |
| Smiles | CC(C)C1CCC(=C)CC1 |
| Nring | 1.0 |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Zingiber Officinale (Plant) Rel Props:Source_db:cmaup_ingredients