2-Bromobutanoyl bromide
TL;DR: 2-Bromobutanoyl bromide (CAS 26074-52-2) is a chemical compound with molecular formula C4H6Br2O and molecular weight 227.88 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-bromobutanoyl bromide
Also Known As: 2-Bromobutyryl bromide, 2-Bromobutanoyl bromide, Butanoyl bromide, 2-bromo-, a-bromobutyryl bromide, 2-bromobutyrylbromide
| Molecular Formula | C4H6Br2O |
|---|---|
| Molecular Weight | 227.88 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 229.8765 |
| Heavy Atoms | 7 |
| Complexity | 72.0 |
Chemical Identifiers
| CAS Number | 26074-52-2 |
|---|---|
| SMILES | CCC(C(=O)Br)Br |
| InChIKey | HHKDBXNYWNUHPL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Bromobutanoyl bromide (CAS 26074-52-2), with molecular formula C4H6Br2O and molecular weight 227.88 g/mol. IUPAC: 2-bromobutanoyl bromide.
Chemical Property Profile of 2-Bromobutanoyl bromide
Property Insights of 2-Bromobutanoyl bromide
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Bromobutanoyl bromide. With a topological polar surface area (TPSA) of 17.1 Ų, 2-Bromobutanoyl bromide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Bromobutanoyl bromide 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-Bromobutanoyl bromide?
The CAS number of 2-Bromobutanoyl bromide is 26074-52-2.
What is the molecular formula of 2-Bromobutanoyl bromide?
The molecular formula of 2-Bromobutanoyl bromide is C4H6Br2O.
What is the molecular weight of 2-Bromobutanoyl bromide?
The molecular weight of 2-Bromobutanoyl bromide is 227.88 g/mol.
Where can I buy 2-Bromobutanoyl bromide?
You can request a quote for 2-Bromobutanoyl bromide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Bromobutanoyl bromide?
Yes, KEHONG BIO provides custom synthesis services for 2-Bromobutanoyl bromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.