1,4-Dibromo-2-methylbutane
TL;DR: 1,4-Dibromo-2-methylbutane (CAS 69498-28-8) is a chemical compound with molecular formula C5H10Br2 and molecular weight 227.91 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,4-dibromo-2-methylbutane
Also Known As: 1,4-Dibromo-2-methylbutane, 1,4-Dibromoisopentane, 2-methyl-1,4-dibromobutane, 1,4-dibromo-2-methyl-butane, Butane, 1,4-dibromo-2-methyl-
| Molecular Formula | C5H10Br2 |
|---|---|
| Molecular Weight | 227.91 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 3 |
| Exact Mass | 227.91493 |
| Heavy Atoms | 7 |
| Complexity | 37.0 |
Chemical Identifiers
| CAS Number | 69498-28-8 |
|---|---|
| SMILES | CC(CCBr)CBr |
| InChIKey | SBCDMKDTWODACO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,4-Dibromo-2-methylbutane (CAS 69498-28-8), with molecular formula C5H10Br2 and molecular weight 227.91 g/mol. IUPAC: 1,4-dibromo-2-methylbutane.
Chemical Property Profile of 1,4-Dibromo-2-methylbutane
Property Insights of 1,4-Dibromo-2-methylbutane
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,4-Dibromo-2-methylbutane. With a topological polar surface area (TPSA) of 0.0 Ų, 1,4-Dibromo-2-methylbutane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,4-Dibromo-2-methylbutane 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 1,4-Dibromo-2-methylbutane?
The CAS number of 1,4-Dibromo-2-methylbutane is 69498-28-8.
What is the molecular formula of 1,4-Dibromo-2-methylbutane?
The molecular formula of 1,4-Dibromo-2-methylbutane is C5H10Br2.
What is the molecular weight of 1,4-Dibromo-2-methylbutane?
The molecular weight of 1,4-Dibromo-2-methylbutane is 227.91 g/mol.
Where can I buy 1,4-Dibromo-2-methylbutane?
You can request a quote for 1,4-Dibromo-2-methylbutane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,4-Dibromo-2-methylbutane?
Yes, KEHONG BIO provides custom synthesis services for 1,4-Dibromo-2-methylbutane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.