(4S)-4-Prop-1-En-2-Ylcyclohexene-1-Carbaldehyde
Representations & DB's id
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| ChEBI: | None | |
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| ChEMBL: | CHEMBL442913 | |
| PubChem: | 2724159 | |
| IUPAC: | (4S)-4-prop-1-en-2-ylcyclohexene-1-carbaldehyde | |
| Standard InChI: | InChI=1S/C10H14O/c1-8(2)10-5-3-9(7-11)4-6-10/h3,7,10H,1,4-6H2,2H3/t10-/m1/s1 | |
| Standard InChI Key: | RUMOYJJNUMEFDD-SNVBAGLBSA-N | |
| SMILES: | O=CC1=CC[C@H](CC1)C(=C)C | |
Molecular propeties
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| AlogP: | 2.49 | |
|---|---|---|
| Hydrogen bonds acceptors: | 1 | |
| Hydrogen bonds donors: | 0 | |
| Rotatable bonds: | 2 | |
| Number of rings: | 1 | |
| Molecular Weight: | 150.1 | |
| Topological polar surface area: | 17.1 | |
| Number of aromatic rings: | 0 | |
| Fsp3: | 0.5 | |
| Number of carbons: | 10 | |
In vitro data
| Activity Type | Activity Value | Target Name | UniProt ID | Ref. |
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