3,7-Diethyl-3a,4,7,7a-tetrahydro-1H-4,7-methanoindene
TL;DR: 3,7-Diethyl-3a,4,7,7a-tetrahydro-1H-4,7-methanoindene (CAS 307496-25-9) is a chemical compound with molecular formula C14H20 and molecular weight 188.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,7-diethyltricyclo[5.2.1.02,6]deca-3,8-diene
Also Known As: Diethyldicyclopentadiene, 3,7-Diethyl-3a,4,7,7a-tetrahydro-1H-4,7-methanoindene, Diethyldicyclopentadiene, mixture of isomers, 4,7-Methano-1H-indene, 3,7-diethyl-3a,4,7,7a-tetrahydro-, 3,7-diethyltricyclo[5.2.1.02,6]deca-3,8-diene
| Molecular Formula | C14H20 |
|---|---|
| Molecular Weight | 188.16 g/mol |
| LogP | 3.945 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 2 |
| Exact Mass | 188.1565 |
| Heavy Atoms | 14 |
| Complexity | 310.0 |
Chemical Identifiers
| CAS Number | 307496-25-9 |
|---|---|
| SMILES | CCC1=CCC2C1C3CC2(C=C3)CC |
Product Overview
3,7-Diethyl-3a,4,7,7a-tetrahydro-1H-4,7-methanoindene (CAS 307496-25-9), with molecular formula C14H20 and molecular weight 188.16 g/mol. IUPAC: 3,7-diethyltricyclo[5.2.1.02,6]deca-3,8-diene.
Chemical Property Profile of 3,7-Diethyl-3a,4,7,7a-tetrahydro-1H-4,7-methanoindene
Property Insights of 3,7-Diethyl-3a,4,7,7a-tetrahydro-1H-4,7-methanoindene
The XLogP value of 3.945 indicates that 3,7-Diethyl-3a,4,7,7a-tetrahydro-1H-4,7-methanoindene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 3,7-Diethyl-3a,4,7,7a-tetrahydro-1H-4,7-methanoindene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,7-Diethyl-3a,4,7,7a-tetrahydro-1H-4,7-methanoindene has 0 hydrogen bond donor(s) and 0 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 3,7-Diethyl-3a,4,7,7a-tetrahydro-1H-4,7-methanoindene?
The CAS number of 3,7-Diethyl-3a,4,7,7a-tetrahydro-1H-4,7-methanoindene is 307496-25-9.
What is the molecular formula of 3,7-Diethyl-3a,4,7,7a-tetrahydro-1H-4,7-methanoindene?
The molecular formula of 3,7-Diethyl-3a,4,7,7a-tetrahydro-1H-4,7-methanoindene is C14H20.
What is the molecular weight of 3,7-Diethyl-3a,4,7,7a-tetrahydro-1H-4,7-methanoindene?
The molecular weight of 3,7-Diethyl-3a,4,7,7a-tetrahydro-1H-4,7-methanoindene is 188.16 g/mol.
Where can I buy 3,7-Diethyl-3a,4,7,7a-tetrahydro-1H-4,7-methanoindene?
You can request a quote for 3,7-Diethyl-3a,4,7,7a-tetrahydro-1H-4,7-methanoindene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,7-Diethyl-3a,4,7,7a-tetrahydro-1H-4,7-methanoindene?
Yes, KEHONG BIO provides custom synthesis services for 3,7-Diethyl-3a,4,7,7a-tetrahydro-1H-4,7-methanoindene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.