1-碘丁烷
TL;DR: 1-碘丁烷 (CAS 542-69-8) is a chemical compound with molecular formula C4H9I and molecular weight 183.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-碘丁烷
1-iodobutane
Also Known As: 1-Iodobutane, Butyl iodide, Butane, 1-iodo-, N-BUTYL IODIDE, 1-iodo-butane
| Molecular Formula | C4H9I |
|---|---|
| Molecular Weight | 183.97 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 2 |
| Exact Mass | 183.9749 |
| Heavy Atoms | 5 |
| Complexity | 13.0 |
| Vapor Pressure | 13.9 [mmHg] |
Chemical Identifiers
| CAS Number | 542-69-8 |
|---|---|
| SMILES | CCCCI |
| InChIKey | KMGBZBJJOKUPIA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-碘丁烷 (CAS 542-69-8), with molecular formula C4H9I and molecular weight 183.97 g/mol. IUPAC: 1-iodobutane.
Chemical Property Profile of 1-碘丁烷
Property Insights of 1-碘丁烷
The XLogP value of 3.1 indicates that 1-碘丁烷 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 1-碘丁烷 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-碘丁烷 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 1-碘丁烷?
The CAS number of 1-碘丁烷 is 542-69-8.
What is the molecular formula of 1-碘丁烷?
The molecular formula of 1-碘丁烷 is C4H9I.
What is the molecular weight of 1-碘丁烷?
The molecular weight of 1-碘丁烷 is 183.97 g/mol.
Where can I buy 1-碘丁烷?
You can request a quote for 1-碘丁烷 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-碘丁烷?
Yes, KEHONG BIO provides custom synthesis services for 1-碘丁烷 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.