TL;DR: (+)-3-Carene (CAS 1352058-87-7) is a chemical compound with molecular formula C10H16 and molecular weight 136.1252 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(1S,6R)-3,7,7-trimethylbicyclo[4.1.0]hept-3-ene
Also Known As: (+)-3-Carene, Isodiprene, (1S)-(+)-3-Carene, (+)-delta3-Carene, (+)-car-3-ene
| Molecular Formula | C10H16 |
| Molecular Weight | 136.1252 g/mol |
| XLogP | 2.8 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 136.1252 Da |
| Heavy Atoms | 10 |
| Complexity | 186.0 |
| SMILES | CC1=CC[C@@H]2[C@H](C1)C2(C)C |
| InChIKey | BQOFWKZOCNGFEC-BDAKNGLRSA-N |
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (+)-3-Carene. With a topological polar surface area (TPSA) of 0.0 Ų, (+)-3-Carene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (+)-3-Carene has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of (+)-3-Carene is 1352058-87-7.
The molecular formula of (+)-3-Carene is C10H16.
The molecular weight of (+)-3-Carene is 136.1252 g/mol.
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