1-Bromo-2,2-bis(bromomethyl)butane
TL;DR: 1-Bromo-2,2-bis(bromomethyl)butane (CAS 89977-22-0) is a chemical compound with molecular formula C6H11Br3 and molecular weight 319.84 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-bromo-2,2-bis(bromomethyl)butane
Also Known As: 1-bromo-2,2-bis(bromomethyl)butane, 1-bromo-2,2-bis butane, 1,1,1-tris(bromomethyl)propane, 1,1,1-tris-(bromomethyl)-propane, Butane,1-bromo-2,2-bis(bromomethyl)-
| Molecular Formula | C6H11Br3 |
|---|---|
| Molecular Weight | 319.84 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 4 |
| Exact Mass | 319.8411 |
| Heavy Atoms | 9 |
| Complexity | 60.0 |
Chemical Identifiers
| CAS Number | 89977-22-0 |
|---|---|
| SMILES | CCC(CBr)(CBr)CBr |
| InChIKey | HUUMSZPUWMAIHD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Bromo-2,2-bis(bromomethyl)butane (CAS 89977-22-0), with molecular formula C6H11Br3 and molecular weight 319.84 g/mol. IUPAC: 1-bromo-2,2-bis(bromomethyl)butane.
Chemical Property Profile of 1-Bromo-2,2-bis(bromomethyl)butane
Property Insights of 1-Bromo-2,2-bis(bromomethyl)butane
The XLogP value of 3.5 indicates that 1-Bromo-2,2-bis(bromomethyl)butane 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-Bromo-2,2-bis(bromomethyl)butane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Bromo-2,2-bis(bromomethyl)butane 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-Bromo-2,2-bis(bromomethyl)butane?
The CAS number of 1-Bromo-2,2-bis(bromomethyl)butane is 89977-22-0.
What is the molecular formula of 1-Bromo-2,2-bis(bromomethyl)butane?
The molecular formula of 1-Bromo-2,2-bis(bromomethyl)butane is C6H11Br3.
What is the molecular weight of 1-Bromo-2,2-bis(bromomethyl)butane?
The molecular weight of 1-Bromo-2,2-bis(bromomethyl)butane is 319.84 g/mol.
Where can I buy 1-Bromo-2,2-bis(bromomethyl)butane?
You can request a quote for 1-Bromo-2,2-bis(bromomethyl)butane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Bromo-2,2-bis(bromomethyl)butane?
Yes, KEHONG BIO provides custom synthesis services for 1-Bromo-2,2-bis(bromomethyl)butane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.