Heptane, 1,1,3-triethoxy-
TL;DR: Heptane, 1,1,3-triethoxy- (CAS 54305-97-4) is a chemical compound with molecular formula C13H28O3 and molecular weight 232.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,1,3-triethoxyheptane
Also Known As: 1,1,3-Triethoxyheptane, Heptane, 1,1,3-triethoxy-, 1,1,3-triethoxy-heptane, 259-083-9, EINECS 259-083-9
| Molecular Formula | C13H28O3 |
|---|---|
| Molecular Weight | 232.20 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 27.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 11 |
| Exact Mass | 232.20384 |
| Heavy Atoms | 16 |
| Complexity | 133.0 |
Chemical Identifiers
| CAS Number | 54305-97-4 |
|---|---|
| SMILES | CCCCC(CC(OCC)OCC)OCC |
| InChIKey | LGHYVXDAOJQRAV-UHFFFAOYSA-N |
Product Overview
Heptane, 1,1,3-triethoxy- (CAS 54305-97-4), with molecular formula C13H28O3 and molecular weight 232.20 g/mol. IUPAC: 1,1,3-triethoxyheptane.
Chemical Property Profile of Heptane, 1,1,3-triethoxy-
Property Insights of Heptane, 1,1,3-triethoxy-
The XLogP value of 3.3 indicates that Heptane, 1,1,3-triethoxy- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 27.7 Ų, Heptane, 1,1,3-triethoxy- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Heptane, 1,1,3-triethoxy- 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 Heptane, 1,1,3-triethoxy-?
The CAS number of Heptane, 1,1,3-triethoxy- is 54305-97-4.
What is the molecular formula of Heptane, 1,1,3-triethoxy-?
The molecular formula of Heptane, 1,1,3-triethoxy- is C13H28O3.
What is the molecular weight of Heptane, 1,1,3-triethoxy-?
The molecular weight of Heptane, 1,1,3-triethoxy- is 232.20 g/mol.
Where can I buy Heptane, 1,1,3-triethoxy-?
You can request a quote for Heptane, 1,1,3-triethoxy- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Heptane, 1,1,3-triethoxy-?
Yes, KEHONG BIO provides custom synthesis services for Heptane, 1,1,3-triethoxy- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.