1,2-Diiodobutane
TL;DR: 1,2-Diiodobutane (CAS 53161-72-1) is a chemical compound with molecular formula C4H8I2 and molecular weight 309.87 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,2-diiodobutane
Also Known As: 1,2-Diiodobutane, 1,2-diiodo-butane, Butane, 1,2-diiodo-, RefChem:1052274
| Molecular Formula | C4H8I2 |
|---|---|
| Molecular Weight | 309.87 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 2 |
| Exact Mass | 309.87155 |
| Heavy Atoms | 6 |
| Complexity | 28.0 |
Chemical Identifiers
| CAS Number | 53161-72-1 |
|---|---|
| SMILES | CCC(CI)I |
| InChIKey | MIAAQPQIWLWRSI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,2-Diiodobutane (CAS 53161-72-1), with molecular formula C4H8I2 and molecular weight 309.87 g/mol. IUPAC: 1,2-diiodobutane.
Chemical Property Profile of 1,2-Diiodobutane
Property Insights of 1,2-Diiodobutane
The XLogP value of 3.6 indicates that 1,2-Diiodobutane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 1,2-Diiodobutane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2-Diiodobutane 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 1,2-Diiodobutane?
The CAS number of 1,2-Diiodobutane is 53161-72-1.
What is the molecular formula of 1,2-Diiodobutane?
The molecular formula of 1,2-Diiodobutane is C4H8I2.
What is the molecular weight of 1,2-Diiodobutane?
The molecular weight of 1,2-Diiodobutane is 309.87 g/mol.
Where can I buy 1,2-Diiodobutane?
You can request a quote for 1,2-Diiodobutane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2-Diiodobutane?
Yes, KEHONG BIO provides custom synthesis services for 1,2-Diiodobutane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.