Heptane, 3-(iodomethyl)-
TL;DR: Heptane, 3-(iodomethyl)- (CAS 1653-16-3) is a chemical compound with molecular formula C8H17I and molecular weight 240.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(iodomethyl)heptane
Also Known As: 2-Ethylhexyl iodide, 3-(Iodomethyl)heptane, Heptane, 3-(iodomethyl)-, 2-ETHYLHEXYLIODIDE, 2-Ethyl-1-iodohexane
| Molecular Formula | C8H17I |
|---|---|
| Molecular Weight | 240.04 g/mol |
| LogP | 5.0 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 5 |
| Exact Mass | 240.0375 |
| Heavy Atoms | 9 |
| Complexity | 52.0 |
Chemical Identifiers
| CAS Number | 1653-16-3 |
|---|---|
| SMILES | CCCCC(CC)CI |
| InChIKey | WNPGSEJRPYSCDQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Heptane, 3-(iodomethyl)- (CAS 1653-16-3), with molecular formula C8H17I and molecular weight 240.04 g/mol. IUPAC: 3-(iodomethyl)heptane.
Chemical Property Profile of Heptane, 3-(iodomethyl)-
Property Insights of Heptane, 3-(iodomethyl)-
The XLogP value of 5.0 indicates that Heptane, 3-(iodomethyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, Heptane, 3-(iodomethyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Heptane, 3-(iodomethyl)- has 0 hydrogen bond donor(s) and 0 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, 3-(iodomethyl)-?
The CAS number of Heptane, 3-(iodomethyl)- is 1653-16-3.
What is the molecular formula of Heptane, 3-(iodomethyl)-?
The molecular formula of Heptane, 3-(iodomethyl)- is C8H17I.
What is the molecular weight of Heptane, 3-(iodomethyl)-?
The molecular weight of Heptane, 3-(iodomethyl)- is 240.04 g/mol.
Where can I buy Heptane, 3-(iodomethyl)-?
You can request a quote for Heptane, 3-(iodomethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Heptane, 3-(iodomethyl)-?
Yes, KEHONG BIO provides custom synthesis services for Heptane, 3-(iodomethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.