4H-3a,6-Methanobenzofuran-2(3H)-one, tetrahydro-8,8-dimethyl-
TL;DR: 4H-3a,6-Methanobenzofuran-2(3H)-one, tetrahydro-8,8-dimethyl- (CAS 6955-34-6) is a chemical compound with molecular formula C11H16O2 and molecular weight 180.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
10,10-dimethyl-4-oxatricyclo[5.2.1.01,5]decan-3-one
Also Known As: dimethyl[?]one, NCIOpen2_001391, 4H-3a,6-Methanobenzofuran-2(3H)-one, tetrahydro-8,8-dimethyl-, Benzothiazole,5-[(1,1-dimethylethyl)thio]-2-methyl, 8,8-dimethyltetrahydro-4H-3a,6-methanobenzofuran-2(3H)-one
| Molecular Formula | C11H16O2 |
|---|---|
| Molecular Weight | 180.12 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 180.11504 |
| Heavy Atoms | 13 |
| Complexity | 282.0 |
Chemical Identifiers
| CAS Number | 6955-34-6 |
|---|---|
| SMILES | CC1(C2CCC13CC(=O)OC3C2)C |
| InChIKey | FJRJQACZNTVQCN-UHFFFAOYSA-N |
Product Overview
4H-3a,6-Methanobenzofuran-2(3H)-one, tetrahydro-8,8-dimethyl- (CAS 6955-34-6), with molecular formula C11H16O2 and molecular weight 180.12 g/mol. IUPAC: 10,10-dimethyl-4-oxatricyclo[5.2.1.01,5]decan-3-one.
Chemical Property Profile of 4H-3a,6-Methanobenzofuran-2(3H)-one, tetrahydro-8,8-dimethyl-
Property Insights of 4H-3a,6-Methanobenzofuran-2(3H)-one, tetrahydro-8,8-dimethyl-
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4H-3a,6-Methanobenzofuran-2(3H)-one, tetrahydro-8,8-dimethyl-. With a topological polar surface area (TPSA) of 26.3 Ų, 4H-3a,6-Methanobenzofuran-2(3H)-one, tetrahydro-8,8-dimethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4H-3a,6-Methanobenzofuran-2(3H)-one, tetrahydro-8,8-dimethyl- 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 4H-3a,6-Methanobenzofuran-2(3H)-one, tetrahydro-8,8-dimethyl-?
The CAS number of 4H-3a,6-Methanobenzofuran-2(3H)-one, tetrahydro-8,8-dimethyl- is 6955-34-6.
What is the molecular formula of 4H-3a,6-Methanobenzofuran-2(3H)-one, tetrahydro-8,8-dimethyl-?
The molecular formula of 4H-3a,6-Methanobenzofuran-2(3H)-one, tetrahydro-8,8-dimethyl- is C11H16O2.
What is the molecular weight of 4H-3a,6-Methanobenzofuran-2(3H)-one, tetrahydro-8,8-dimethyl-?
The molecular weight of 4H-3a,6-Methanobenzofuran-2(3H)-one, tetrahydro-8,8-dimethyl- is 180.12 g/mol.
Where can I buy 4H-3a,6-Methanobenzofuran-2(3H)-one, tetrahydro-8,8-dimethyl-?
You can request a quote for 4H-3a,6-Methanobenzofuran-2(3H)-one, tetrahydro-8,8-dimethyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4H-3a,6-Methanobenzofuran-2(3H)-one, tetrahydro-8,8-dimethyl-?
Yes, KEHONG BIO provides custom synthesis services for 4H-3a,6-Methanobenzofuran-2(3H)-one, tetrahydro-8,8-dimethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.