![3-[(1-Methylethoxy)methyl]heptane structure](/static/products/942/94200-86-9.png)
3-[(1-Methylethoxy)methyl]heptane
TL;DR: 3-[(1-Methylethoxy)methyl]heptane (CAS 94200-86-9) is a chemical compound with molecular formula C11H24O and molecular weight 172.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(propan-2-yloxymethyl)heptane
Also Known As: EINECS 303-567-5, 3-((1-Methylethoxy)methyl)heptane, 3-[(1-METHYLETHOXY)METHYL]HEPTANE, 3-(propan-2-yloxymethyl)heptane, 2-ethyl-1-(propan-2-yloxy)hexane
| Molecular Formula | C11H24O |
|---|---|
| Molecular Weight | 172.18 g/mol |
| LogP | 3.6278 |
| Topological Polar Surface Area | 9.23 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 7 |
| Exact Mass | 172.18271 |
| Heavy Atoms | 12 |
| Complexity | 89.004906 |
Chemical Identifiers
| CAS Number | 94200-86-9 |
|---|---|
| SMILES | CCCCC(CC)COC(C)C |
Product Overview
3-[(1-Methylethoxy)methyl]heptane (CAS 94200-86-9), with molecular formula C11H24O and molecular weight 172.18 g/mol. IUPAC: 3-(propan-2-yloxymethyl)heptane.
Chemical Property Profile of 3-[(1-Methylethoxy)methyl]heptane
Property Insights of 3-[(1-Methylethoxy)methyl]heptane
The XLogP value of 3.6278 indicates that 3-[(1-Methylethoxy)methyl]heptane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 9.23 Ų, 3-[(1-Methylethoxy)methyl]heptane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-[(1-Methylethoxy)methyl]heptane 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 3-[(1-Methylethoxy)methyl]heptane?
The CAS number of 3-[(1-Methylethoxy)methyl]heptane is 94200-86-9.
What is the molecular formula of 3-[(1-Methylethoxy)methyl]heptane?
The molecular formula of 3-[(1-Methylethoxy)methyl]heptane is C11H24O.
What is the molecular weight of 3-[(1-Methylethoxy)methyl]heptane?
The molecular weight of 3-[(1-Methylethoxy)methyl]heptane is 172.18 g/mol.
Where can I buy 3-[(1-Methylethoxy)methyl]heptane?
You can request a quote for 3-[(1-Methylethoxy)methyl]heptane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[(1-Methylethoxy)methyl]heptane?
Yes, KEHONG BIO provides custom synthesis services for 3-[(1-Methylethoxy)methyl]heptane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.