TL;DR: (1R,2S,3S,4S)-3-vinylbicyclo[2.2.1]heptane-2-carbaldehyde (CAS 156880-57-8) is a chemical compound with molecular formula C10H14O and molecular weight 150.10446 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(1R,2S,3S,4S)-3-ethenylbicyclo[2.2.1]heptane-2-carbaldehyde
Also Known As: (1R,2S,3S,4S)-3-ethenylbicyclo[2.2.1]heptane-2-carbaldehyde, (1R,2S,3S,4S)-3-vinylbicyclo[2.2.1]heptane-2-carbaldehyde, Bicyclo[2.2.1]heptane-2-carboxaldehyde, 3-ethenyl-, [1R-(2-exo,3-endo)]- (9CI), bicyclo[2.2.1]heptane-2-carboxaldehyde, 3-ethenyl-, (1R,2S,3S,4S)-
| Molecular Formula | C10H14O |
| Molecular Weight | 150.10446 g/mol |
| XLogP | 2.3 |
| Topological Polar Surface Area (TPSA) | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 150.10446 Da |
| Heavy Atoms | 11 |
| Complexity | 185.0 |
| SMILES | C=C[C@H]1[C@H]2CC[C@H](C2)[C@@H]1C=O |
| InChIKey | JCKKBRXWDBWAEP-JXUBOQSCSA-N |
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (1R,2S,3S,4S)-3-vinylbicyclo[2.2.1]heptane-2-carbaldehyde. With a topological polar surface area (TPSA) of 17.1 Ų, (1R,2S,3S,4S)-3-vinylbicyclo[2.2.1]heptane-2-carbaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (1R,2S,3S,4S)-3-vinylbicyclo[2.2.1]heptane-2-carbaldehyde has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of (1R,2S,3S,4S)-3-vinylbicyclo[2.2.1]heptane-2-carbaldehyde is 156880-57-8.
The molecular formula of (1R,2S,3S,4S)-3-vinylbicyclo[2.2.1]heptane-2-carbaldehyde is C10H14O.
The molecular weight of (1R,2S,3S,4S)-3-vinylbicyclo[2.2.1]heptane-2-carbaldehyde is 150.10446 g/mol.
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