15-Hydroperoxyabietic acid
TL;DR: 15-Hydroperoxyabietic acid (CAS 13010-45-2) is a chemical compound with molecular formula C20H30O4 and molecular weight 334.21442 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl (1R,4aR,4bR,10aR)-7-(2-hydroperoxypropan-2-yl)-4a-methyl-2,3,4,4b,5,6,10,10a-octahydro-1H-phenanthrene-1-carboxylate
Also Known As: 15-Hydroperoxyabietic acid, 15-Hpa, 15-hydroperoxy-abietic acid, 15-hydroperoxy abietic acid, methyl (1R,4aR,4bR,10aR)-7-(2-hydroperoxypropan-2-yl)-4a-methyl-2,3,4,4b,5,6,10,10a-octahydro-1H-phenanthrene-1-carboxylate
Technical Specifications
| Molecular Formula | C20H30O4 |
| Molecular Weight | 334.21442 g/mol |
| XLogP | 3.4 |
| Topological Polar Surface Area (TPSA) | 55.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 334.21442 Da |
| Heavy Atoms | 24 |
| Complexity | 574.0 |
| SMILES | C[C@@]12CCC[C@H]([C@H]1CC=C3[C@@H]2CCC(=C3)C(C)(C)OO)C(=O)OC |
| InChIKey | CMIAIUZBKPLIOP-YZLZLFLDSA-N |
Chemical Property Profile of 15-Hydroperoxyabietic acid
Property Insights of 15-Hydroperoxyabietic acid
The XLogP value of 3.4 indicates that 15-Hydroperoxyabietic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.8 Ų, 15-Hydroperoxyabietic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 15-Hydroperoxyabietic acid has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 15-Hydroperoxyabietic acid?
The CAS number of 15-Hydroperoxyabietic acid is 13010-45-2.
What is the molecular formula of 15-Hydroperoxyabietic acid?
The molecular formula of 15-Hydroperoxyabietic acid is C20H30O4.
What is the molecular weight of 15-Hydroperoxyabietic acid?
The molecular weight of 15-Hydroperoxyabietic acid is 334.21442 g/mol.
Where can I buy 15-Hydroperoxyabietic acid?
You can request a quote for 15-Hydroperoxyabietic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 15-Hydroperoxyabietic acid?
Yes, CoreyChem provides custom synthesis services for 15-Hydroperoxyabietic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.