alpha,alpha,6,6-Tetramethylbicyclo(3.1.1)hept-2-ene-2-propanal
TL;DR: alpha,alpha,6,6-Tetramethylbicyclo(3.1.1)hept-2-ene-2-propanal (CAS 33885-52-8) is a chemical compound with molecular formula C14H22O and molecular weight 206.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(6,6-dimethyl-2-bicyclo[3.1.1]hept-2-enyl)-2,2-dimethylpropanal
Also Known As: Tetramethyl bicyclo-2-heptene-2-propionaldehyde, 3-(6,6-Dimethylbicyclo[3.1.1]hept-2-en-2-yl)-2,2-dimethylpropanal, bicyclo(3.1.1)hept-2-ene-2-propanal,, A,, A,6,6-tetramethyl-
| Molecular Formula | C14H22O |
|---|---|
| Molecular Weight | 206.17 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 206.16707 |
| Heavy Atoms | 15 |
| Complexity | 309.0 |
Chemical Identifiers
| CAS Number | 33885-52-8 |
|---|---|
| SMILES | CC1(C2CC=C(C1C2)CC(C)(C)C=O)C |
| InChIKey | GVSTVIASYRSHQM-UHFFFAOYSA-N |
Product Overview
alpha,alpha,6,6-Tetramethylbicyclo(3.1.1)hept-2-ene-2-propanal (CAS 33885-52-8), with molecular formula C14H22O and molecular weight 206.17 g/mol. IUPAC: 3-(6,6-dimethyl-2-bicyclo[3.1.1]hept-2-enyl)-2,2-dimethylpropanal.
Chemical Property Profile of alpha,alpha,6,6-Tetramethylbicyclo(3.1.1)hept-2-ene-2-propanal
Property Insights of alpha,alpha,6,6-Tetramethylbicyclo(3.1.1)hept-2-ene-2-propanal
The XLogP value of 3.1 indicates that alpha,alpha,6,6-Tetramethylbicyclo(3.1.1)hept-2-ene-2-propanal is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, alpha,alpha,6,6-Tetramethylbicyclo(3.1.1)hept-2-ene-2-propanal exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, alpha,alpha,6,6-Tetramethylbicyclo(3.1.1)hept-2-ene-2-propanal 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 alpha,alpha,6,6-Tetramethylbicyclo(3.1.1)hept-2-ene-2-propanal?
The CAS number of alpha,alpha,6,6-Tetramethylbicyclo(3.1.1)hept-2-ene-2-propanal is 33885-52-8.
What is the molecular formula of alpha,alpha,6,6-Tetramethylbicyclo(3.1.1)hept-2-ene-2-propanal?
The molecular formula of alpha,alpha,6,6-Tetramethylbicyclo(3.1.1)hept-2-ene-2-propanal is C14H22O.
What is the molecular weight of alpha,alpha,6,6-Tetramethylbicyclo(3.1.1)hept-2-ene-2-propanal?
The molecular weight of alpha,alpha,6,6-Tetramethylbicyclo(3.1.1)hept-2-ene-2-propanal is 206.17 g/mol.
Where can I buy alpha,alpha,6,6-Tetramethylbicyclo(3.1.1)hept-2-ene-2-propanal?
You can request a quote for alpha,alpha,6,6-Tetramethylbicyclo(3.1.1)hept-2-ene-2-propanal directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for alpha,alpha,6,6-Tetramethylbicyclo(3.1.1)hept-2-ene-2-propanal?
Yes, KEHONG BIO provides custom synthesis services for alpha,alpha,6,6-Tetramethylbicyclo(3.1.1)hept-2-ene-2-propanal and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.