Cyclobuta(a)pentalene-6-acetic acid, decahydro-6,6a-dihydroxy-2a,4,4-trimethyl-, methyl ester, (2aR-(2aalpha,2bbeta,5abeta,6alpha,6aalpha))-
TL;DR: Cyclobuta(a)pentalene-6-acetic acid, decahydro-6,6a-dihydroxy-2a,4,4-trimethyl-, methyl ester, (2aR-(2aalpha,2bbeta,5abeta,6alpha,6aalpha))- (CAS 125882-87-3) is a chemical compound with molecular formula C16H26O4 and molecular weight 282.1831 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl 2-[(1S,2R,5S,6R,7R)-5,6-dihydroxy-2,9,9-trimethyl-6-tricyclo[5.3.0.02,5]decanyl]acetate
Also Known As: Cyclobuta(a)pentalene-6-acetic acid, decahydro-6,6a-dihydroxy-2a,4,4-trimethyl-, methyl ester, (2aR-(2aalpha,2bbeta,5abeta,6alpha,6aalpha))-, Methyl (6,6a-dihydroxy-2a,4,4-trimethyldecahydrocyclobuta[a]pentalen-6-yl)acetate, Cyclobuta(a)pentalene-6-acetic acid, decahydro-6,6a-dihydroxy-2a,4,4-trimethyl-, methyl ester, (2aR-(2aalpha,2bbeta,5abeta,6alpha,6aalpha))-, methyl [(2aR,2bS,5aR,6R,6aS)-6,6a-dihydroxy-2a,4,4-trimethyldecahydrocyclobuta[a]pentalen-6-yl]acetate
Technical Specifications
| Molecular Formula | C16H26O4 |
| Molecular Weight | 282.1831 g/mol |
| XLogP | 2.3 |
| Topological Polar Surface Area (TPSA) | 66.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 282.1831 Da |
| Heavy Atoms | 20 |
| Complexity | 459.0 |
| SMILES | C[C@]12CC[C@]1([C@]([C@H]3[C@@H]2CC(C3)(C)C)(CC(=O)OC)O)O |
| InChIKey | ADBVQMVBLYKSAE-WUFOEMFESA-N |
Chemical Property Profile of Cyclobuta(a)pentalene-6-acetic acid, decahydro-6,6a-dihydroxy-2a,4,4-trimethyl-, methyl ester, (2aR-(2aalpha,2bbeta,5abeta,6alpha,6aalpha))-
Property Insights of Cyclobuta(a)pentalene-6-acetic acid, decahydro-6,6a-dihydroxy-2a,4,4-trimethyl-, methyl ester, (2aR-(2aalpha,2bbeta,5abeta,6alpha,6aalpha))-
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Cyclobuta(a)pentalene-6-acetic acid, decahydro-6,6a-dihydroxy-2a,4,4-trimethyl-, methyl ester, (2aR-(2aalpha,2bbeta,5abeta,6alpha,6aalpha))-. The TPSA of 66.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Cyclobuta(a)pentalene-6-acetic acid, decahydro-6,6a-dihydroxy-2a,4,4-trimethyl-, methyl ester, (2aR-(2aalpha,2bbeta,5abeta,6alpha,6aalpha))-. Following Lipinski's Rule of Five, Cyclobuta(a)pentalene-6-acetic acid, decahydro-6,6a-dihydroxy-2a,4,4-trimethyl-, methyl ester, (2aR-(2aalpha,2bbeta,5abeta,6alpha,6aalpha))- has 2 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 Cyclobuta(a)pentalene-6-acetic acid, decahydro-6,6a-dihydroxy-2a,4,4-trimethyl-, methyl ester, (2aR-(2aalpha,2bbeta,5abeta,6alpha,6aalpha))-?
The CAS number of Cyclobuta(a)pentalene-6-acetic acid, decahydro-6,6a-dihydroxy-2a,4,4-trimethyl-, methyl ester, (2aR-(2aalpha,2bbeta,5abeta,6alpha,6aalpha))- is 125882-87-3.
What is the molecular formula of Cyclobuta(a)pentalene-6-acetic acid, decahydro-6,6a-dihydroxy-2a,4,4-trimethyl-, methyl ester, (2aR-(2aalpha,2bbeta,5abeta,6alpha,6aalpha))-?
The molecular formula of Cyclobuta(a)pentalene-6-acetic acid, decahydro-6,6a-dihydroxy-2a,4,4-trimethyl-, methyl ester, (2aR-(2aalpha,2bbeta,5abeta,6alpha,6aalpha))- is C16H26O4.
What is the molecular weight of Cyclobuta(a)pentalene-6-acetic acid, decahydro-6,6a-dihydroxy-2a,4,4-trimethyl-, methyl ester, (2aR-(2aalpha,2bbeta,5abeta,6alpha,6aalpha))-?
The molecular weight of Cyclobuta(a)pentalene-6-acetic acid, decahydro-6,6a-dihydroxy-2a,4,4-trimethyl-, methyl ester, (2aR-(2aalpha,2bbeta,5abeta,6alpha,6aalpha))- is 282.1831 g/mol.
Where can I buy Cyclobuta(a)pentalene-6-acetic acid, decahydro-6,6a-dihydroxy-2a,4,4-trimethyl-, methyl ester, (2aR-(2aalpha,2bbeta,5abeta,6alpha,6aalpha))-?
You can request a quote for Cyclobuta(a)pentalene-6-acetic acid, decahydro-6,6a-dihydroxy-2a,4,4-trimethyl-, methyl ester, (2aR-(2aalpha,2bbeta,5abeta,6alpha,6aalpha))- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Cyclobuta(a)pentalene-6-acetic acid, decahydro-6,6a-dihydroxy-2a,4,4-trimethyl-, methyl ester, (2aR-(2aalpha,2bbeta,5abeta,6alpha,6aalpha))-?
Yes, CoreyChem provides custom synthesis services for Cyclobuta(a)pentalene-6-acetic acid, decahydro-6,6a-dihydroxy-2a,4,4-trimethyl-, methyl ester, (2aR-(2aalpha,2bbeta,5abeta,6alpha,6aalpha))- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.