1,2,7-Trimethoxyheptane
TL;DR: 1,2,7-Trimethoxyheptane (CAS 62635-57-8) is a chemical compound with molecular formula C10H22O3 and molecular weight 190.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,2,7-trimethoxyheptane
Also Known As: 1,2,7-Trimethoxyheptane, Heptane, 1,2,7-trimethoxy-, RefChem:215421
| Molecular Formula | C10H22O3 |
|---|---|
| Molecular Weight | 190.16 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 27.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 9 |
| Exact Mass | 190.15689 |
| Heavy Atoms | 13 |
| Complexity | 96.0 |
Chemical Identifiers
| CAS Number | 62635-57-8 |
|---|---|
| SMILES | COCCCCCC(COC)OC |
| InChIKey | ILPAVCQQBMVHQL-UHFFFAOYSA-N |
Product Overview
1,2,7-Trimethoxyheptane (CAS 62635-57-8), with molecular formula C10H22O3 and molecular weight 190.16 g/mol. IUPAC: 1,2,7-trimethoxyheptane.
Chemical Property Profile of 1,2,7-Trimethoxyheptane
Property Insights of 1,2,7-Trimethoxyheptane
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,2,7-Trimethoxyheptane. With a topological polar surface area (TPSA) of 27.7 Ų, 1,2,7-Trimethoxyheptane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2,7-Trimethoxyheptane has 0 hydrogen bond donor(s) and 3 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 1,2,7-Trimethoxyheptane?
The CAS number of 1,2,7-Trimethoxyheptane is 62635-57-8.
What is the molecular formula of 1,2,7-Trimethoxyheptane?
The molecular formula of 1,2,7-Trimethoxyheptane is C10H22O3.
What is the molecular weight of 1,2,7-Trimethoxyheptane?
The molecular weight of 1,2,7-Trimethoxyheptane is 190.16 g/mol.
Where can I buy 1,2,7-Trimethoxyheptane?
You can request a quote for 1,2,7-Trimethoxyheptane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2,7-Trimethoxyheptane?
Yes, KEHONG BIO provides custom synthesis services for 1,2,7-Trimethoxyheptane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.