丁烯酰溴
TL;DR: 丁烯酰溴 (CAS 55600-70-9) is a chemical compound with molecular formula C4H5BrO and molecular weight 147.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
丁烯酰溴
but-2-enoyl bromide
Also Known As: Crotonyl bromide, butenoyl bromide, but-2-enoyl bromide, (E)-but-2-enoyl bromide
| Molecular Formula | C4H5BrO |
|---|---|
| Molecular Weight | 147.95 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 147.95238 |
| Heavy Atoms | 6 |
| Complexity | 75.0 |
Chemical Identifiers
| CAS Number | 55600-70-9 |
|---|---|
| SMILES | CC=CC(=O)Br |
| InChIKey | ZILJGEDLVRILOP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
丁烯酰溴 (CAS 55600-70-9), with molecular formula C4H5BrO and molecular weight 147.95 g/mol. IUPAC: but-2-enoyl bromide.
Chemical Property Profile of 丁烯酰溴
Property Insights of 丁烯酰溴
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 丁烯酰溴. With a topological polar surface area (TPSA) of 17.1 Ų, 丁烯酰溴 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 丁烯酰溴 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 丁烯酰溴?
The CAS number of 丁烯酰溴 is 55600-70-9.
What is the molecular formula of 丁烯酰溴?
The molecular formula of 丁烯酰溴 is C4H5BrO.
What is the molecular weight of 丁烯酰溴?
The molecular weight of 丁烯酰溴 is 147.95 g/mol.
Where can I buy 丁烯酰溴?
You can request a quote for 丁烯酰溴 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 丁烯酰溴?
Yes, KEHONG BIO provides custom synthesis services for 丁烯酰溴 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.