2-溴丁酰氯
TL;DR: 2-溴丁酰氯 (CAS 22118-12-3) is a chemical compound with molecular formula C4H6BrClO and molecular weight 183.93 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-溴丁酰氯
2-bromobutanoyl chloride
Also Known As: 2-Bromobutyryl chloride, 2-bromobutanoyl chloride, 2-BromobutyrylChloride, Butanoyl chloride,2-bromo-, 2-bromo-butyryl chloride
| Molecular Formula | C4H6BrClO |
|---|---|
| Molecular Weight | 183.93 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 183.92906 |
| Heavy Atoms | 7 |
| Complexity | 74.0 |
Chemical Identifiers
| CAS Number | 22118-12-3 |
|---|---|
| SMILES | CCC(C(=O)Cl)Br |
| InChIKey | DROZQELYZZXYSX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 13 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-溴丁酰氯 (CAS 22118-12-3), with molecular formula C4H6BrClO and molecular weight 183.93 g/mol. IUPAC: 2-bromobutanoyl chloride.
Chemical Property Profile of 2-溴丁酰氯
Property Insights of 2-溴丁酰氯
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-溴丁酰氯. With a topological polar surface area (TPSA) of 17.1 Ų, 2-溴丁酰氯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-溴丁酰氯 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-溴丁酰氯?
The CAS number of 2-溴丁酰氯 is 22118-12-3.
What is the molecular formula of 2-溴丁酰氯?
The molecular formula of 2-溴丁酰氯 is C4H6BrClO.
What is the molecular weight of 2-溴丁酰氯?
The molecular weight of 2-溴丁酰氯 is 183.93 g/mol.
Where can I buy 2-溴丁酰氯?
You can request a quote for 2-溴丁酰氯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-溴丁酰氯?
Yes, KEHONG BIO provides custom synthesis services for 2-溴丁酰氯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.