Octahydro-4,7-methano-1H-indene-5-carbaldehyde
TL;DR: Octahydro-4,7-methano-1H-indene-5-carbaldehyde (CAS 4791-70-2) is a chemical compound with molecular formula C11H16O and molecular weight 164.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tricyclo[5.2.1.02,6]decane-8-carbaldehyde
Also Known As: Chasmanine, Octahydro-4,7-methano-1H-indene-5-carbaldehyde, tricyclo[5.2.1.02,6]decane-8-carbaldehyde, octahydro-1H-4,7-methanoindene-5-carbaldehyde, EINECS 225-340-9
| Molecular Formula | C11H16O |
|---|---|
| Molecular Weight | 164.12 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 164.12012 |
| Heavy Atoms | 12 |
| Complexity | 211.0 |
Chemical Identifiers
| CAS Number | 4791-70-2 |
|---|---|
| SMILES | C1CC2C(C1)C3CC2CC3C=O |
| InChIKey | GYCQGFPKRVWXQT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Octahydro-4,7-methano-1H-indene-5-carbaldehyde (CAS 4791-70-2), with molecular formula C11H16O and molecular weight 164.12 g/mol. IUPAC: tricyclo[5.2.1.02,6]decane-8-carbaldehyde.
Chemical Property Profile of Octahydro-4,7-methano-1H-indene-5-carbaldehyde
Property Insights of Octahydro-4,7-methano-1H-indene-5-carbaldehyde
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Octahydro-4,7-methano-1H-indene-5-carbaldehyde. With a topological polar surface area (TPSA) of 17.1 Ų, Octahydro-4,7-methano-1H-indene-5-carbaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Octahydro-4,7-methano-1H-indene-5-carbaldehyde 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 Octahydro-4,7-methano-1H-indene-5-carbaldehyde?
The CAS number of Octahydro-4,7-methano-1H-indene-5-carbaldehyde is 4791-70-2.
What is the molecular formula of Octahydro-4,7-methano-1H-indene-5-carbaldehyde?
The molecular formula of Octahydro-4,7-methano-1H-indene-5-carbaldehyde is C11H16O.
What is the molecular weight of Octahydro-4,7-methano-1H-indene-5-carbaldehyde?
The molecular weight of Octahydro-4,7-methano-1H-indene-5-carbaldehyde is 164.12 g/mol.
Where can I buy Octahydro-4,7-methano-1H-indene-5-carbaldehyde?
You can request a quote for Octahydro-4,7-methano-1H-indene-5-carbaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Octahydro-4,7-methano-1H-indene-5-carbaldehyde?
Yes, KEHONG BIO provides custom synthesis services for Octahydro-4,7-methano-1H-indene-5-carbaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.