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Bicyclo[3.3.1]non-6-ene-3-carboxylic acid
TL;DR: Bicyclo[3.3.1]non-6-ene-3-carboxylic acid (CAS 21932-98-9) is a chemical compound with molecular formula C10H14O2 and molecular weight 166.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bicyclo[3.3.1]non-6-ene-3-carboxylic acid
Also Known As: Bicyclo[3.3.1]non-6-ene-3-carboxylic acid, NCI60_007869, Bicyclo[3.3.1]non-6-ene-3-carboxylicacid, bicyclo(3,3,1)non-6-ene-3-carboxylic acid, bicyclo(3.3.1)non-6-ene-3-carboxylic acid
| Molecular Formula | C10H14O2 |
|---|---|
| Molecular Weight | 166.10 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 166.09938 |
| Heavy Atoms | 12 |
| Complexity | 220.0 |
Chemical Identifiers
| CAS Number | 21932-98-9 |
|---|---|
| SMILES | C1C=CC2CC1CC(C2)C(=O)O |
| InChIKey | FFRDKUOKEIXXRA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Bicyclo[3.3.1]non-6-ene-3-carboxylic acid (CAS 21932-98-9), with molecular formula C10H14O2 and molecular weight 166.10 g/mol. IUPAC: bicyclo[3.3.1]non-6-ene-3-carboxylic acid.
Chemical Property Profile of Bicyclo[3.3.1]non-6-ene-3-carboxylic acid
Property Insights of Bicyclo[3.3.1]non-6-ene-3-carboxylic acid
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Bicyclo[3.3.1]non-6-ene-3-carboxylic acid. With a topological polar surface area (TPSA) of 37.3 Ų, Bicyclo[3.3.1]non-6-ene-3-carboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Bicyclo[3.3.1]non-6-ene-3-carboxylic acid has 1 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[3.3.1]non-6-ene-3-carboxylic acid?
The CAS number of Bicyclo[3.3.1]non-6-ene-3-carboxylic acid is 21932-98-9.
What is the molecular formula of Bicyclo[3.3.1]non-6-ene-3-carboxylic acid?
The molecular formula of Bicyclo[3.3.1]non-6-ene-3-carboxylic acid is C10H14O2.
What is the molecular weight of Bicyclo[3.3.1]non-6-ene-3-carboxylic acid?
The molecular weight of Bicyclo[3.3.1]non-6-ene-3-carboxylic acid is 166.10 g/mol.
Where can I buy Bicyclo[3.3.1]non-6-ene-3-carboxylic acid?
You can request a quote for Bicyclo[3.3.1]non-6-ene-3-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bicyclo[3.3.1]non-6-ene-3-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for Bicyclo[3.3.1]non-6-ene-3-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.