3a,4,5,6-Tetrahydro-1,1,3-trimethylindancarbaldehyde
TL;DR: 3a,4,5,6-Tetrahydro-1,1,3-trimethylindancarbaldehyde (CAS 97999-29-6) is a chemical compound with molecular formula C13H20O and molecular weight 192.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3,3-trimethyl-1,2,5,6,7,7a-hexahydroindene-2-carbaldehyde
Also Known As: EINECS 308-425-6, 3a,4,5,6-Tetrahydro-1,1,3-trimethylindancarbaldehyde, 1,3,3-trimethyl-1,2,5,6,7,7a-hexahydroindene-2-carbaldehyde, 1,1,3-Trimethyl-2,3,3a,4,5,6-hexahydro-1H-indene-2-carbaldehyde
| Molecular Formula | C13H20O |
|---|---|
| Molecular Weight | 192.15 g/mol |
| LogP | 3.2039 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 192.15141 |
| Heavy Atoms | 14 |
| Complexity | 274.96014 |
Chemical Identifiers
| CAS Number | 97999-29-6 |
|---|---|
| SMILES | CC1C2CCCC=C2C(C1C=O)(C)C |
Product Overview
3a,4,5,6-Tetrahydro-1,1,3-trimethylindancarbaldehyde (CAS 97999-29-6), with molecular formula C13H20O and molecular weight 192.15 g/mol. IUPAC: 1,3,3-trimethyl-1,2,5,6,7,7a-hexahydroindene-2-carbaldehyde.
Chemical Property Profile of 3a,4,5,6-Tetrahydro-1,1,3-trimethylindancarbaldehyde
Property Insights of 3a,4,5,6-Tetrahydro-1,1,3-trimethylindancarbaldehyde
The XLogP value of 3.2039 indicates that 3a,4,5,6-Tetrahydro-1,1,3-trimethylindancarbaldehyde is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.07 Ų, 3a,4,5,6-Tetrahydro-1,1,3-trimethylindancarbaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3a,4,5,6-Tetrahydro-1,1,3-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
Frequently Asked Questions
What is the CAS number of 3a,4,5,6-Tetrahydro-1,1,3-trimethylindancarbaldehyde?
The CAS number of 3a,4,5,6-Tetrahydro-1,1,3-trimethylindancarbaldehyde is 97999-29-6.
What is the molecular formula of 3a,4,5,6-Tetrahydro-1,1,3-trimethylindancarbaldehyde?
The molecular formula of 3a,4,5,6-Tetrahydro-1,1,3-trimethylindancarbaldehyde is C13H20O.
What is the molecular weight of 3a,4,5,6-Tetrahydro-1,1,3-trimethylindancarbaldehyde?
The molecular weight of 3a,4,5,6-Tetrahydro-1,1,3-trimethylindancarbaldehyde is 192.15 g/mol.
Where can I buy 3a,4,5,6-Tetrahydro-1,1,3-trimethylindancarbaldehyde?
You can request a quote for 3a,4,5,6-Tetrahydro-1,1,3-trimethylindancarbaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3a,4,5,6-Tetrahydro-1,1,3-trimethylindancarbaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 3a,4,5,6-Tetrahydro-1,1,3-trimethylindancarbaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.