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Ethanol, 2-(3,3-dimethylbicyclo[2.2.1]hept-2-ylidene)-
TL;DR: Ethanol, 2-(3,3-dimethylbicyclo[2.2.1]hept-2-ylidene)- (CAS 2226-05-3) is a chemical compound with molecular formula C11H18O and molecular weight 166.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3,3-dimethyl-2-bicyclo[2.2.1]heptanylidene)ethanol
Also Known As: Ethanol, 2-(3,3-dimethylbicyclo[2.2.1]hept-2-ylidene)-, 2-(3,3-dimethyl-2-bicyclo[2.2.1]heptanylidene)ethanol, 2-(3,3-dimethylbicyclo[2.2.1]hept-2-ylidene)ethanol, DELTA-2, BETA-NORBORNANE ETHANOL, 3,3-DIMETHYL, (E)-2-(3,3-dimethylbicyclo[2.2.1]hept-2-ylidene)ethanol
| Molecular Formula | C11H18O |
|---|---|
| Molecular Weight | 166.14 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 166.13577 |
| Heavy Atoms | 12 |
| Complexity | 215.0 |
Chemical Identifiers
| CAS Number | 2226-05-3 |
|---|---|
| SMILES | CC1(C2CCC(C2)C1=CCO)C |
| InChIKey | JGDHOHFQJJATNG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ethanol, 2-(3,3-dimethylbicyclo[2.2.1]hept-2-ylidene)- (CAS 2226-05-3), with molecular formula C11H18O and molecular weight 166.14 g/mol. IUPAC: 2-(3,3-dimethyl-2-bicyclo[2.2.1]heptanylidene)ethanol.
Chemical Property Profile of Ethanol, 2-(3,3-dimethylbicyclo[2.2.1]hept-2-ylidene)-
Property Insights of Ethanol, 2-(3,3-dimethylbicyclo[2.2.1]hept-2-ylidene)-
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethanol, 2-(3,3-dimethylbicyclo[2.2.1]hept-2-ylidene)-. With a topological polar surface area (TPSA) of 20.2 Ų, Ethanol, 2-(3,3-dimethylbicyclo[2.2.1]hept-2-ylidene)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethanol, 2-(3,3-dimethylbicyclo[2.2.1]hept-2-ylidene)- has 1 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 Ethanol, 2-(3,3-dimethylbicyclo[2.2.1]hept-2-ylidene)-?
The CAS number of Ethanol, 2-(3,3-dimethylbicyclo[2.2.1]hept-2-ylidene)- is 2226-05-3.
What is the molecular formula of Ethanol, 2-(3,3-dimethylbicyclo[2.2.1]hept-2-ylidene)-?
The molecular formula of Ethanol, 2-(3,3-dimethylbicyclo[2.2.1]hept-2-ylidene)- is C11H18O.
What is the molecular weight of Ethanol, 2-(3,3-dimethylbicyclo[2.2.1]hept-2-ylidene)-?
The molecular weight of Ethanol, 2-(3,3-dimethylbicyclo[2.2.1]hept-2-ylidene)- is 166.14 g/mol.
Where can I buy Ethanol, 2-(3,3-dimethylbicyclo[2.2.1]hept-2-ylidene)-?
You can request a quote for Ethanol, 2-(3,3-dimethylbicyclo[2.2.1]hept-2-ylidene)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethanol, 2-(3,3-dimethylbicyclo[2.2.1]hept-2-ylidene)-?
Yes, KEHONG BIO provides custom synthesis services for Ethanol, 2-(3,3-dimethylbicyclo[2.2.1]hept-2-ylidene)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.