4H-Cyclobut(e)inden-4-one, decahydro-2a-hydroxy-3,6,6,7b-tetramethyl-, (2aR-(2aalpha,3alpha,4abeta,7abeta,7balpha))-
TL;DR: 4H-Cyclobut(e)inden-4-one, decahydro-2a-hydroxy-3,6,6,7b-tetramethyl-, (2aR-(2aalpha,3alpha,4abeta,7abeta,7balpha))- (CAS 125949-59-9) is a chemical compound with molecular formula C15H24O2 and molecular weight 236.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2aR,3S,4aR,7aS,7bR)-2a-hydroxy-3,6,6,7b-tetramethyl-2,3,4a,5,7,7a-hexahydro-1H-cyclobuta[e]inden-4-one
Also Known As: 4H-Cyclobut(e)inden-4-one, decahydro-2a-hydroxy-3,6,6,7b-tetramethyl-, (2aR-(2aalpha,3alpha,4abeta,7abeta,7balpha))-, 2a-Hydroxy-3,6,6,7b-tetramethyldecahydro-4H-cyclobuta[e]inden-4-one, (2aR,3S,4aR,7aS,7bR)-2a-hydroxy-3,6,6,7b-tetramethyldecahydro-4H-cyclobuta[e]inden-4-one, (2aR,3S,4aR,7aS,7bR)-2a-hydroxy-3,6,6,7b-tetramethyl-2,3,4a,5,7,7a-hexahydro-1H-cyclobuta[e]inden-4-one
| Molecular Formula | C15H24O2 |
|---|---|
| Molecular Weight | 236.18 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 236.17763 |
| Heavy Atoms | 17 |
| Complexity | 386.0 |
Chemical Identifiers
| CAS Number | 125949-59-9 |
|---|---|
| SMILES | C[C@@H]1C(=O)[C@@H]2CC(C[C@@H]2[C@@]3([C@]1(CC3)O)C)(C)C |
| InChIKey | YFIXPNVIFRNVFU-IUPFNGILSA-N |
Product Overview
4H-Cyclobut(e)inden-4-one, decahydro-2a-hydroxy-3,6,6,7b-tetramethyl-, (2aR-(2aalpha,3alpha,4abeta,7abeta,7balpha))- (CAS 125949-59-9), with molecular formula C15H24O2 and molecular weight 236.18 g/mol. IUPAC: (2aR,3S,4aR,7aS,7bR)-2a-hydroxy-3,6,6,7b-tetramethyl-2,3,4a,5,7,7a-hexahydro-1H-cyclobuta[e]inden-4-one.
Chemical Property Profile of 4H-Cyclobut(e)inden-4-one, decahydro-2a-hydroxy-3,6,6,7b-tetramethyl-, (2aR-(2aalpha,3alpha,4abeta,7abeta,7balpha))-
Property Insights of 4H-Cyclobut(e)inden-4-one, decahydro-2a-hydroxy-3,6,6,7b-tetramethyl-, (2aR-(2aalpha,3alpha,4abeta,7abeta,7balpha))-
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4H-Cyclobut(e)inden-4-one, decahydro-2a-hydroxy-3,6,6,7b-tetramethyl-, (2aR-(2aalpha,3alpha,4abeta,7abeta,7balpha))-. With a topological polar surface area (TPSA) of 37.3 Ų, 4H-Cyclobut(e)inden-4-one, decahydro-2a-hydroxy-3,6,6,7b-tetramethyl-, (2aR-(2aalpha,3alpha,4abeta,7abeta,7balpha))- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4H-Cyclobut(e)inden-4-one, decahydro-2a-hydroxy-3,6,6,7b-tetramethyl-, (2aR-(2aalpha,3alpha,4abeta,7abeta,7balpha))- has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4H-Cyclobut(e)inden-4-one, decahydro-2a-hydroxy-3,6,6,7b-tetramethyl-, (2aR-(2aalpha,3alpha,4abeta,7abeta,7balpha))-?
The CAS number of 4H-Cyclobut(e)inden-4-one, decahydro-2a-hydroxy-3,6,6,7b-tetramethyl-, (2aR-(2aalpha,3alpha,4abeta,7abeta,7balpha))- is 125949-59-9.
What is the molecular formula of 4H-Cyclobut(e)inden-4-one, decahydro-2a-hydroxy-3,6,6,7b-tetramethyl-, (2aR-(2aalpha,3alpha,4abeta,7abeta,7balpha))-?
The molecular formula of 4H-Cyclobut(e)inden-4-one, decahydro-2a-hydroxy-3,6,6,7b-tetramethyl-, (2aR-(2aalpha,3alpha,4abeta,7abeta,7balpha))- is C15H24O2.
What is the molecular weight of 4H-Cyclobut(e)inden-4-one, decahydro-2a-hydroxy-3,6,6,7b-tetramethyl-, (2aR-(2aalpha,3alpha,4abeta,7abeta,7balpha))-?
The molecular weight of 4H-Cyclobut(e)inden-4-one, decahydro-2a-hydroxy-3,6,6,7b-tetramethyl-, (2aR-(2aalpha,3alpha,4abeta,7abeta,7balpha))- is 236.18 g/mol.
Where can I buy 4H-Cyclobut(e)inden-4-one, decahydro-2a-hydroxy-3,6,6,7b-tetramethyl-, (2aR-(2aalpha,3alpha,4abeta,7abeta,7balpha))-?
You can request a quote for 4H-Cyclobut(e)inden-4-one, decahydro-2a-hydroxy-3,6,6,7b-tetramethyl-, (2aR-(2aalpha,3alpha,4abeta,7abeta,7balpha))- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4H-Cyclobut(e)inden-4-one, decahydro-2a-hydroxy-3,6,6,7b-tetramethyl-, (2aR-(2aalpha,3alpha,4abeta,7abeta,7balpha))-?
Yes, KEHONG BIO provides custom synthesis services for 4H-Cyclobut(e)inden-4-one, decahydro-2a-hydroxy-3,6,6,7b-tetramethyl-, (2aR-(2aalpha,3alpha,4abeta,7abeta,7balpha))- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.