(2E)-2-(3,3-dimethyl-2-bicyclo[2.2.1]heptanylidene)acetaldehyde
TL;DR: (2E)-2-(3,3-dimethyl-2-bicyclo[2.2.1]heptanylidene)acetaldehyde (CAS 64802-77-3) 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.
(2E)-2-(3,3-dimethyl-2-bicyclo[2.2.1]heptanylidene)acetaldehyde
Also Known As: (3,3-Dimethyl-bicyclo[2.2.1]hept-2-ylidene)-acetaldehyde, (2E)-2-(3,3-dimethyl-2-bicyclo[2.2.1]heptanylidene)acetaldehyde, (2E)-2-(6,6-dimethyl-5-bicyclo[2.2.1]heptylidene)acetaldehyde
| Molecular Formula | C11H16O |
|---|---|
| Molecular Weight | 164.12 g/mol |
| LogP | 2.5678 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 164.12012 |
| Heavy Atoms | 12 |
| Complexity | 237.38867 |
Chemical Identifiers
| CAS Number | 64802-77-3 |
|---|---|
| SMILES | CC\1(C2CCC(C2)/C1=C\C=O)C |
Product Overview
(2E)-2-(3,3-dimethyl-2-bicyclo[2.2.1]heptanylidene)acetaldehyde (CAS 64802-77-3), with molecular formula C11H16O and molecular weight 164.12 g/mol. IUPAC: (2E)-2-(3,3-dimethyl-2-bicyclo[2.2.1]heptanylidene)acetaldehyde.
Chemical Property Profile of (2E)-2-(3,3-dimethyl-2-bicyclo[2.2.1]heptanylidene)acetaldehyde
Property Insights of (2E)-2-(3,3-dimethyl-2-bicyclo[2.2.1]heptanylidene)acetaldehyde
The XLogP value of 2.5678 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2E)-2-(3,3-dimethyl-2-bicyclo[2.2.1]heptanylidene)acetaldehyde. With a topological polar surface area (TPSA) of 17.07 Ų, (2E)-2-(3,3-dimethyl-2-bicyclo[2.2.1]heptanylidene)acetaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2E)-2-(3,3-dimethyl-2-bicyclo[2.2.1]heptanylidene)acetaldehyde 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 (2E)-2-(3,3-dimethyl-2-bicyclo[2.2.1]heptanylidene)acetaldehyde?
The CAS number of (2E)-2-(3,3-dimethyl-2-bicyclo[2.2.1]heptanylidene)acetaldehyde is 64802-77-3.
What is the molecular formula of (2E)-2-(3,3-dimethyl-2-bicyclo[2.2.1]heptanylidene)acetaldehyde?
The molecular formula of (2E)-2-(3,3-dimethyl-2-bicyclo[2.2.1]heptanylidene)acetaldehyde is C11H16O.
What is the molecular weight of (2E)-2-(3,3-dimethyl-2-bicyclo[2.2.1]heptanylidene)acetaldehyde?
The molecular weight of (2E)-2-(3,3-dimethyl-2-bicyclo[2.2.1]heptanylidene)acetaldehyde is 164.12 g/mol.
Where can I buy (2E)-2-(3,3-dimethyl-2-bicyclo[2.2.1]heptanylidene)acetaldehyde?
You can request a quote for (2E)-2-(3,3-dimethyl-2-bicyclo[2.2.1]heptanylidene)acetaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2E)-2-(3,3-dimethyl-2-bicyclo[2.2.1]heptanylidene)acetaldehyde?
Yes, KEHONG BIO provides custom synthesis services for (2E)-2-(3,3-dimethyl-2-bicyclo[2.2.1]heptanylidene)acetaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.