![Bicyclo[3.1.1]heptan-2-one structure](/static/products/1715/17159-87-4.webp)
Bicyclo[3.1.1]heptan-2-one
TL;DR: Bicyclo[3.1.1]heptan-2-one (CAS 17159-87-4) is a chemical compound with molecular formula C7H10O and molecular weight 110.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bicyclo[3.1.1]heptan-2-one
Also Known As: Bicyclo[3.1.1]heptan-2-one, norpinan-2-one, norpinone, bicyclo[3.1.1]heptan-4-one, bicyclo[3,1,1]heptan-2-one
| Molecular Formula | C7H10O |
|---|---|
| Molecular Weight | 110.07 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 110.073166 |
| Heavy Atoms | 8 |
| Complexity | 122.0 |
Chemical Identifiers
| CAS Number | 17159-87-4 |
|---|---|
| SMILES | C1CC(=O)C2CC1C2 |
| InChIKey | PMAXNHPFNDQMAO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Bicyclo[3.1.1]heptan-2-one (CAS 17159-87-4), with molecular formula C7H10O and molecular weight 110.07 g/mol. IUPAC: bicyclo[3.1.1]heptan-2-one.
Chemical Property Profile of Bicyclo[3.1.1]heptan-2-one
Property Insights of Bicyclo[3.1.1]heptan-2-one
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Bicyclo[3.1.1]heptan-2-one. With a topological polar surface area (TPSA) of 17.1 Ų, Bicyclo[3.1.1]heptan-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Bicyclo[3.1.1]heptan-2-one has 0 hydrogen bond donor(s) and 1 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[3.1.1]heptan-2-one?
The CAS number of Bicyclo[3.1.1]heptan-2-one is 17159-87-4.
What is the molecular formula of Bicyclo[3.1.1]heptan-2-one?
The molecular formula of Bicyclo[3.1.1]heptan-2-one is C7H10O.
What is the molecular weight of Bicyclo[3.1.1]heptan-2-one?
The molecular weight of Bicyclo[3.1.1]heptan-2-one is 110.07 g/mol.
Where can I buy Bicyclo[3.1.1]heptan-2-one?
You can request a quote for Bicyclo[3.1.1]heptan-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bicyclo[3.1.1]heptan-2-one?
Yes, KEHONG BIO provides custom synthesis services for Bicyclo[3.1.1]heptan-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.