2-Iodobutane
TL;DR: 2-Iodobutane (CAS 513-48-4) 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.
2-iodobutane
Also Known As: 2-IODOBUTANE, sec-Butyl iodide, 2-Butyl iodide, Butane, 2-iodo-, sec-Iodobutane
| Molecular Formula | C4H9I |
|---|---|
| Molecular Weight | 183.97 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 1 |
| Exact Mass | 183.9749 |
| Heavy Atoms | 5 |
| Complexity | 19.0 |
| Vapor Pressure | 17.1 [mmHg] |
Chemical Identifiers
| CAS Number | 513-48-4 |
|---|---|
| SMILES | CCC(C)I |
| InChIKey | IQRUSQUYPCHEKN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 18 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Iodobutane (CAS 513-48-4), with molecular formula C4H9I and molecular weight 183.97 g/mol. IUPAC: 2-iodobutane.
Chemical Property Profile of 2-Iodobutane
Property Insights of 2-Iodobutane
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Iodobutane. With a topological polar surface area (TPSA) of 0.0 Ų, 2-Iodobutane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Iodobutane 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 2-Iodobutane?
The CAS number of 2-Iodobutane is 513-48-4.
What is the molecular formula of 2-Iodobutane?
The molecular formula of 2-Iodobutane is C4H9I.
What is the molecular weight of 2-Iodobutane?
The molecular weight of 2-Iodobutane is 183.97 g/mol.
Where can I buy 2-Iodobutane?
You can request a quote for 2-Iodobutane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Iodobutane?
Yes, KEHONG BIO provides custom synthesis services for 2-Iodobutane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.