Heptane, 1,1-diethoxy-
TL;DR: Heptane, 1,1-diethoxy- (CAS 688-82-4) is a chemical compound with molecular formula C11H24O2 and molecular weight 188.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,1-diethoxyheptane
Also Known As: 1,1-Diethoxyheptane, Heptanal-diethylacetal, Heptane, 1,1-diethoxy-, Heptanal, diethyl acetal, heptanal diethyl acetal
| Molecular Formula | C11H24O2 |
|---|---|
| Molecular Weight | 188.18 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 9 |
| Exact Mass | 188.17763 |
| Heavy Atoms | 13 |
| Complexity | 88.0 |
Chemical Identifiers
| CAS Number | 688-82-4 |
|---|---|
| SMILES | CCCCCCC(OCC)OCC |
| InChIKey | UGOCNHASEZIJFQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Heptane, 1,1-diethoxy- (CAS 688-82-4), with molecular formula C11H24O2 and molecular weight 188.18 g/mol. IUPAC: 1,1-diethoxyheptane.
Chemical Property Profile of Heptane, 1,1-diethoxy-
Property Insights of Heptane, 1,1-diethoxy-
The XLogP value of 3.7 indicates that Heptane, 1,1-diethoxy- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 18.5 Ų, Heptane, 1,1-diethoxy- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Heptane, 1,1-diethoxy- has 0 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 Heptane, 1,1-diethoxy-?
The CAS number of Heptane, 1,1-diethoxy- is 688-82-4.
What is the molecular formula of Heptane, 1,1-diethoxy-?
The molecular formula of Heptane, 1,1-diethoxy- is C11H24O2.
What is the molecular weight of Heptane, 1,1-diethoxy-?
The molecular weight of Heptane, 1,1-diethoxy- is 188.18 g/mol.
Where can I buy Heptane, 1,1-diethoxy-?
You can request a quote for Heptane, 1,1-diethoxy- 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-diethoxy-?
Yes, KEHONG BIO provides custom synthesis services for Heptane, 1,1-diethoxy- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.