2-(4-Propylheptan-4-yloxy)ethanol
TL;DR: 2-(4-Propylheptan-4-yloxy)ethanol (CAS 70709-97-6) is a chemical compound with molecular formula C12H26O2 and molecular weight 202.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-propylheptan-4-yloxy)ethanol
Also Known As: 2-(1,1-DIPROPYLBUTOXY)ETHANOL, 2-(4-propylheptan-4-yloxy)ethanol, 2-[(4-propylheptan-4-yl)oxy]ethan-1-ol, ETHANOL,2-(1,1-DIPROPYLBUTOXY)-, J1.589.551I
| Molecular Formula | C12H26O2 |
|---|---|
| Molecular Weight | 202.19 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 9 |
| Exact Mass | 202.19328 |
| Heavy Atoms | 14 |
| Complexity | 106.0 |
Chemical Identifiers
| CAS Number | 70709-97-6 |
|---|---|
| SMILES | CCCC(CCC)(CCC)OCCO |
| InChIKey | AOXKGDOQEXIVGF-UHFFFAOYSA-N |
Product Overview
2-(4-Propylheptan-4-yloxy)ethanol (CAS 70709-97-6), with molecular formula C12H26O2 and molecular weight 202.19 g/mol. IUPAC: 2-(4-propylheptan-4-yloxy)ethanol.
Chemical Property Profile of 2-(4-Propylheptan-4-yloxy)ethanol
Property Insights of 2-(4-Propylheptan-4-yloxy)ethanol
The XLogP value of 3.0 indicates that 2-(4-Propylheptan-4-yloxy)ethanol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.5 Ų, 2-(4-Propylheptan-4-yloxy)ethanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(4-Propylheptan-4-yloxy)ethanol has 1 hydrogen bond donor(s) and 2 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 2-(4-Propylheptan-4-yloxy)ethanol?
The CAS number of 2-(4-Propylheptan-4-yloxy)ethanol is 70709-97-6.
What is the molecular formula of 2-(4-Propylheptan-4-yloxy)ethanol?
The molecular formula of 2-(4-Propylheptan-4-yloxy)ethanol is C12H26O2.
What is the molecular weight of 2-(4-Propylheptan-4-yloxy)ethanol?
The molecular weight of 2-(4-Propylheptan-4-yloxy)ethanol is 202.19 g/mol.
Where can I buy 2-(4-Propylheptan-4-yloxy)ethanol?
You can request a quote for 2-(4-Propylheptan-4-yloxy)ethanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-Propylheptan-4-yloxy)ethanol?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Propylheptan-4-yloxy)ethanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.