2-丁氧基乙基溴
TL;DR: 2-丁氧基乙基溴 (CAS 6550-99-8) is a chemical compound with molecular formula C6H13BrO and molecular weight 180.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-丁氧基乙基溴
1-(2-bromoethoxy)butane
Also Known As: 1-(2-Bromoethoxy)butane, 2-Butoxyethyl bromide, 2-Bromoethyl butyl ether, 2-(n-Butoxy)ethyl bromide, butoxy-2-bromo-ethane
| Molecular Formula | C6H13BrO |
|---|---|
| Molecular Weight | 180.01 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Exact Mass | 180.01498 |
| Heavy Atoms | 8 |
| Complexity | 39.0 |
Chemical Identifiers
| CAS Number | 6550-99-8 |
|---|---|
| SMILES | CCCCOCCBr |
| InChIKey | WOLUYEFMPZAHNN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-丁氧基乙基溴 (CAS 6550-99-8), with molecular formula C6H13BrO and molecular weight 180.01 g/mol. IUPAC: 1-(2-bromoethoxy)butane.
Chemical Property Profile of 2-丁氧基乙基溴
Property Insights of 2-丁氧基乙基溴
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-丁氧基乙基溴. With a topological polar surface area (TPSA) of 9.2 Ų, 2-丁氧基乙基溴 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-丁氧基乙基溴 has 0 hydrogen bond donor(s) and 1 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-丁氧基乙基溴?
The CAS number of 2-丁氧基乙基溴 is 6550-99-8.
What is the molecular formula of 2-丁氧基乙基溴?
The molecular formula of 2-丁氧基乙基溴 is C6H13BrO.
What is the molecular weight of 2-丁氧基乙基溴?
The molecular weight of 2-丁氧基乙基溴 is 180.01 g/mol.
Where can I buy 2-丁氧基乙基溴?
You can request a quote for 2-丁氧基乙基溴 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-丁氧基乙基溴?
Yes, KEHONG BIO provides custom synthesis services for 2-丁氧基乙基溴 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.