6-Hydroxy-6,7,7-trimethyl-2-oxaspiro[4.4]nonan-1-one
TL;DR: 6-Hydroxy-6,7,7-trimethyl-2-oxaspiro[4.4]nonan-1-one (CAS 7229-31-4) is a chemical compound with molecular formula C11H18O3 and molecular weight 198.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-hydroxy-8,8,9-trimethyl-2-oxaspiro[4.4]nonan-1-one
Also Known As: 6-Hydroxy-6,7,7-trimethyl-2-oxaspiro[4.4]nonan-1-one, 1-hydroxy-1,2,2-trimethyl-8-oxaspiro[4.4]nonan-9-one, 4-hydroxy-3,3,4-trimethyl-8-oxaspiro[4.4]nonan-9-one
| Molecular Formula | C11H18O3 |
|---|---|
| Molecular Weight | 198.13 g/mol |
| LogP | 1.4907 |
| Topological Polar Surface Area | 46.53 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 198.1256 |
| Heavy Atoms | 14 |
| Complexity | 280.25723 |
Chemical Identifiers
| CAS Number | 7229-31-4 |
|---|---|
| SMILES | CC1(CCC2(C1(C)O)CCOC2=O)C |
Product Overview
6-Hydroxy-6,7,7-trimethyl-2-oxaspiro[4.4]nonan-1-one (CAS 7229-31-4), with molecular formula C11H18O3 and molecular weight 198.13 g/mol. IUPAC: 9-hydroxy-8,8,9-trimethyl-2-oxaspiro[4.4]nonan-1-one.
Chemical Property Profile of 6-Hydroxy-6,7,7-trimethyl-2-oxaspiro[4.4]nonan-1-one
Property Insights of 6-Hydroxy-6,7,7-trimethyl-2-oxaspiro[4.4]nonan-1-one
The XLogP value of 1.4907 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Hydroxy-6,7,7-trimethyl-2-oxaspiro[4.4]nonan-1-one. With a topological polar surface area (TPSA) of 46.53 Ų, 6-Hydroxy-6,7,7-trimethyl-2-oxaspiro[4.4]nonan-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Hydroxy-6,7,7-trimethyl-2-oxaspiro[4.4]nonan-1-one has 1 hydrogen bond donor(s) and 3 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 6-Hydroxy-6,7,7-trimethyl-2-oxaspiro[4.4]nonan-1-one?
The CAS number of 6-Hydroxy-6,7,7-trimethyl-2-oxaspiro[4.4]nonan-1-one is 7229-31-4.
What is the molecular formula of 6-Hydroxy-6,7,7-trimethyl-2-oxaspiro[4.4]nonan-1-one?
The molecular formula of 6-Hydroxy-6,7,7-trimethyl-2-oxaspiro[4.4]nonan-1-one is C11H18O3.
What is the molecular weight of 6-Hydroxy-6,7,7-trimethyl-2-oxaspiro[4.4]nonan-1-one?
The molecular weight of 6-Hydroxy-6,7,7-trimethyl-2-oxaspiro[4.4]nonan-1-one is 198.13 g/mol.
Where can I buy 6-Hydroxy-6,7,7-trimethyl-2-oxaspiro[4.4]nonan-1-one?
You can request a quote for 6-Hydroxy-6,7,7-trimethyl-2-oxaspiro[4.4]nonan-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Hydroxy-6,7,7-trimethyl-2-oxaspiro[4.4]nonan-1-one?
Yes, KEHONG BIO provides custom synthesis services for 6-Hydroxy-6,7,7-trimethyl-2-oxaspiro[4.4]nonan-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.