Bicyclo[2.2.1]heptan-2-one, 4-methoxy-1,7,7-trimethyl-
TL;DR: Bicyclo[2.2.1]heptan-2-one, 4-methoxy-1,7,7-trimethyl- (CAS 88653-52-5) is a chemical compound with molecular formula C11H18O2 and molecular weight 182.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methoxy-1,7,7-trimethylbicyclo[2.2.1]heptan-2-one
Also Known As: Bicyclo[2.2.1]heptan-2-one, 4-methoxy-1,7,7-trimethyl-, 4-Methoxy-1,7,7-trimethylbicyclo[2.2.1]heptan-2-one, 4-Methoxy-1,7,7-trimethylbicyclo[2.2.1]heptan-2-one #
| Molecular Formula | C11H18O2 |
|---|---|
| Molecular Weight | 182.13 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 182.13068 |
| Heavy Atoms | 13 |
| Complexity | 269.0 |
Chemical Identifiers
| CAS Number | 88653-52-5 |
|---|---|
| SMILES | CC1(C2(CCC1(CC2=O)OC)C)C |
| InChIKey | OMSCLXZYTCFKNY-UHFFFAOYSA-N |
Product Overview
Bicyclo[2.2.1]heptan-2-one, 4-methoxy-1,7,7-trimethyl- (CAS 88653-52-5), with molecular formula C11H18O2 and molecular weight 182.13 g/mol. IUPAC: 4-methoxy-1,7,7-trimethylbicyclo[2.2.1]heptan-2-one.
Chemical Property Profile of Bicyclo[2.2.1]heptan-2-one, 4-methoxy-1,7,7-trimethyl-
Property Insights of Bicyclo[2.2.1]heptan-2-one, 4-methoxy-1,7,7-trimethyl-
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Bicyclo[2.2.1]heptan-2-one, 4-methoxy-1,7,7-trimethyl-. With a topological polar surface area (TPSA) of 26.3 Ų, Bicyclo[2.2.1]heptan-2-one, 4-methoxy-1,7,7-trimethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Bicyclo[2.2.1]heptan-2-one, 4-methoxy-1,7,7-trimethyl- 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 Bicyclo[2.2.1]heptan-2-one, 4-methoxy-1,7,7-trimethyl-?
The CAS number of Bicyclo[2.2.1]heptan-2-one, 4-methoxy-1,7,7-trimethyl- is 88653-52-5.
What is the molecular formula of Bicyclo[2.2.1]heptan-2-one, 4-methoxy-1,7,7-trimethyl-?
The molecular formula of Bicyclo[2.2.1]heptan-2-one, 4-methoxy-1,7,7-trimethyl- is C11H18O2.
What is the molecular weight of Bicyclo[2.2.1]heptan-2-one, 4-methoxy-1,7,7-trimethyl-?
The molecular weight of Bicyclo[2.2.1]heptan-2-one, 4-methoxy-1,7,7-trimethyl- is 182.13 g/mol.
Where can I buy Bicyclo[2.2.1]heptan-2-one, 4-methoxy-1,7,7-trimethyl-?
You can request a quote for Bicyclo[2.2.1]heptan-2-one, 4-methoxy-1,7,7-trimethyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bicyclo[2.2.1]heptan-2-one, 4-methoxy-1,7,7-trimethyl-?
Yes, KEHONG BIO provides custom synthesis services for Bicyclo[2.2.1]heptan-2-one, 4-methoxy-1,7,7-trimethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.