3a,4,5,6-Tetrahydro-2,2,3a-trimethylindancarbaldehyde
TL;DR: 3a,4,5,6-Tetrahydro-2,2,3a-trimethylindancarbaldehyde (CAS 100231-76-3) is a chemical compound with molecular formula C13H20O and molecular weight 192.15141 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2,2,3a-trimethyl-3,4,5,6-tetrahydro-1H-indene-1-carbaldehyde
Also Known As: 3a,4,5,6-Tetrahydro-2,2,3a-trimethylindancarbaldehyde, 2,2,3a-trimethyl-3,4,5,6-tetrahydro-1H-indene-1-carbaldehyde, 1H-Indenecarboxaldehyde, 2,3,3a,4,5,6-hexahydro-2,2,3a-trimethyl- (9CI), 2,2,3a-Trimethyl-2,3,3a,4,5,6-hexahydro-1H-indene-1-carbaldehyde, EINECS 309-377-9
Technical Specifications
| Molecular Formula | C13H20O |
| Molecular Weight | 192.15141 g/mol |
| XLogP | 3.3 |
| Topological Polar Surface Area (TPSA) | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 192.15141 Da |
| Heavy Atoms | 14 |
| Complexity | 288.0 |
| SMILES | CC1(CC2(CCCC=C2C1C=O)C)C |
| InChIKey | GOWIYTQTDKCRDA-UHFFFAOYSA-N |
Chemical Property Profile of 3a,4,5,6-Tetrahydro-2,2,3a-trimethylindancarbaldehyde
Property Insights of 3a,4,5,6-Tetrahydro-2,2,3a-trimethylindancarbaldehyde
The XLogP value of 3.3 indicates that 3a,4,5,6-Tetrahydro-2,2,3a-trimethylindancarbaldehyde is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, 3a,4,5,6-Tetrahydro-2,2,3a-trimethylindancarbaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3a,4,5,6-Tetrahydro-2,2,3a-trimethylindancarbaldehyde 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
What is the CAS number of 3a,4,5,6-Tetrahydro-2,2,3a-trimethylindancarbaldehyde?
The CAS number of 3a,4,5,6-Tetrahydro-2,2,3a-trimethylindancarbaldehyde is 100231-76-3.
What is the molecular formula of 3a,4,5,6-Tetrahydro-2,2,3a-trimethylindancarbaldehyde?
The molecular formula of 3a,4,5,6-Tetrahydro-2,2,3a-trimethylindancarbaldehyde is C13H20O.
What is the molecular weight of 3a,4,5,6-Tetrahydro-2,2,3a-trimethylindancarbaldehyde?
The molecular weight of 3a,4,5,6-Tetrahydro-2,2,3a-trimethylindancarbaldehyde is 192.15141 g/mol.
Where can I buy 3a,4,5,6-Tetrahydro-2,2,3a-trimethylindancarbaldehyde?
You can request a quote for 3a,4,5,6-Tetrahydro-2,2,3a-trimethylindancarbaldehyde directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3a,4,5,6-Tetrahydro-2,2,3a-trimethylindancarbaldehyde?
Yes, CoreyChem provides custom synthesis services for 3a,4,5,6-Tetrahydro-2,2,3a-trimethylindancarbaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.