6-(3-Ethoxybuten-1-yl)-1,5,5-trimethylcyclohexene
TL;DR: 6-(3-Ethoxybuten-1-yl)-1,5,5-trimethylcyclohexene (CAS 70172-07-5) is a chemical compound with molecular formula C15H26O and molecular weight 222.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-[(E)-3-ethoxybut-1-enyl]-1,5,5-trimethylcyclohexene
Also Known As: EINECS 274-359-9, 6- -1,5,5-trimethylcyclohexene, 6-(3-Ethoxybuten-1-yl)-1,5,5-trimethylcyclohexene, 6-(3-Ethoxy-1-butenyl)-1,5,5-trimethylcyclohexene, 6-(3-ethoxybut-1-en-1-yl)-1,5,5-trimethylcyclohex-1-ene
| Molecular Formula | C15H26O |
|---|---|
| Molecular Weight | 222.20 g/mol |
| LogP | 4.3501 |
| Topological Polar Surface Area | 9.23 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 222.19836 |
| Heavy Atoms | 16 |
| Complexity | 273.15955 |
Chemical Identifiers
| CAS Number | 70172-07-5 |
|---|---|
| SMILES | CCOC(C)/C=C/C1C(=CCCC1(C)C)C |
Product Overview
6-(3-Ethoxybuten-1-yl)-1,5,5-trimethylcyclohexene (CAS 70172-07-5), with molecular formula C15H26O and molecular weight 222.20 g/mol. IUPAC: 6-[(E)-3-ethoxybut-1-enyl]-1,5,5-trimethylcyclohexene.
Chemical Property Profile of 6-(3-Ethoxybuten-1-yl)-1,5,5-trimethylcyclohexene
Property Insights of 6-(3-Ethoxybuten-1-yl)-1,5,5-trimethylcyclohexene
The XLogP value of 4.3501 indicates that 6-(3-Ethoxybuten-1-yl)-1,5,5-trimethylcyclohexene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 9.23 Ų, 6-(3-Ethoxybuten-1-yl)-1,5,5-trimethylcyclohexene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-(3-Ethoxybuten-1-yl)-1,5,5-trimethylcyclohexene 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 6-(3-Ethoxybuten-1-yl)-1,5,5-trimethylcyclohexene?
The CAS number of 6-(3-Ethoxybuten-1-yl)-1,5,5-trimethylcyclohexene is 70172-07-5.
What is the molecular formula of 6-(3-Ethoxybuten-1-yl)-1,5,5-trimethylcyclohexene?
The molecular formula of 6-(3-Ethoxybuten-1-yl)-1,5,5-trimethylcyclohexene is C15H26O.
What is the molecular weight of 6-(3-Ethoxybuten-1-yl)-1,5,5-trimethylcyclohexene?
The molecular weight of 6-(3-Ethoxybuten-1-yl)-1,5,5-trimethylcyclohexene is 222.20 g/mol.
Where can I buy 6-(3-Ethoxybuten-1-yl)-1,5,5-trimethylcyclohexene?
You can request a quote for 6-(3-Ethoxybuten-1-yl)-1,5,5-trimethylcyclohexene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-(3-Ethoxybuten-1-yl)-1,5,5-trimethylcyclohexene?
Yes, KEHONG BIO provides custom synthesis services for 6-(3-Ethoxybuten-1-yl)-1,5,5-trimethylcyclohexene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.