1,5-Dioxaspiro(5.5)undecane, 9-(1,1-dimethylethyl)-2-methyl-
TL;DR: 1,5-Dioxaspiro(5.5)undecane, 9-(1,1-dimethylethyl)-2-methyl- (CAS 63449-90-1) is a chemical compound with molecular formula C14H26O2 and molecular weight 226.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-tert-butyl-4-methyl-1,5-dioxaspiro[5.5]undecane
Also Known As: 9-tert-butyl-2-methyl-1,5-dioxaspiro[5.5]undecane, 1,5-Dioxaspiro[5.5]undecane, 9-(1,1-dimethylethyl)-2-methyl-, 9-tert-butyl-4-methyl-1,5-dioxaspiro[5.5]undecane, 9-2-methyl-1,5-dioxaspiro[5.5]undecane, 9- -2-methyl-1,5-dioxaspiro[5.5]undecane
| Molecular Formula | C14H26O2 |
|---|---|
| Molecular Weight | 226.19 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 226.19328 |
| Heavy Atoms | 16 |
| Complexity | 234.0 |
Chemical Identifiers
| CAS Number | 63449-90-1 |
|---|---|
| SMILES | CC1CCOC2(O1)CCC(CC2)C(C)(C)C |
| InChIKey | YXVMHTMPUCZZEW-UHFFFAOYSA-N |
Product Overview
1,5-Dioxaspiro(5.5)undecane, 9-(1,1-dimethylethyl)-2-methyl- (CAS 63449-90-1), with molecular formula C14H26O2 and molecular weight 226.19 g/mol. IUPAC: 9-tert-butyl-4-methyl-1,5-dioxaspiro[5.5]undecane.
Chemical Property Profile of 1,5-Dioxaspiro(5.5)undecane, 9-(1,1-dimethylethyl)-2-methyl-
Property Insights of 1,5-Dioxaspiro(5.5)undecane, 9-(1,1-dimethylethyl)-2-methyl-
The XLogP value of 3.7 indicates that 1,5-Dioxaspiro(5.5)undecane, 9-(1,1-dimethylethyl)-2-methyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 18.5 Ų, 1,5-Dioxaspiro(5.5)undecane, 9-(1,1-dimethylethyl)-2-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,5-Dioxaspiro(5.5)undecane, 9-(1,1-dimethylethyl)-2-methyl- has 0 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 1,5-Dioxaspiro(5.5)undecane, 9-(1,1-dimethylethyl)-2-methyl-?
The CAS number of 1,5-Dioxaspiro(5.5)undecane, 9-(1,1-dimethylethyl)-2-methyl- is 63449-90-1.
What is the molecular formula of 1,5-Dioxaspiro(5.5)undecane, 9-(1,1-dimethylethyl)-2-methyl-?
The molecular formula of 1,5-Dioxaspiro(5.5)undecane, 9-(1,1-dimethylethyl)-2-methyl- is C14H26O2.
What is the molecular weight of 1,5-Dioxaspiro(5.5)undecane, 9-(1,1-dimethylethyl)-2-methyl-?
The molecular weight of 1,5-Dioxaspiro(5.5)undecane, 9-(1,1-dimethylethyl)-2-methyl- is 226.19 g/mol.
Where can I buy 1,5-Dioxaspiro(5.5)undecane, 9-(1,1-dimethylethyl)-2-methyl-?
You can request a quote for 1,5-Dioxaspiro(5.5)undecane, 9-(1,1-dimethylethyl)-2-methyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,5-Dioxaspiro(5.5)undecane, 9-(1,1-dimethylethyl)-2-methyl-?
Yes, KEHONG BIO provides custom synthesis services for 1,5-Dioxaspiro(5.5)undecane, 9-(1,1-dimethylethyl)-2-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.