溴乙酰溴
TL;DR: 溴乙酰溴 (CAS 598-21-0) is a chemical compound with molecular formula C2H2Br2O and molecular weight 199.85 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
溴乙酰溴
2-bromoacetyl bromide
Also Known As: Bromoacetyl bromide, 2-Bromoacetyl bromide, bromoacetylbromide, ACETYL BROMIDE, BROMO-, bromo acetyl bromide
| Molecular Formula | C2H2Br2O |
|---|---|
| Molecular Weight | 199.85 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 201.84518 |
| Heavy Atoms | 5 |
| Complexity | 42.0 |
| Boiling Point | 147.8 °C at 760 mmHg |
| Density | 2.317 at 20.0 °C |
Chemical Identifiers
| CAS Number | 598-21-0 |
|---|---|
| SMILES | C(C(=O)Br)Br |
| InChIKey | LSTRKXWIZZZYAS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 20 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
溴乙酰溴 (CAS 598-21-0), with molecular formula C2H2Br2O and molecular weight 199.85 g/mol. IUPAC: 2-bromoacetyl bromide.
Chemical Property Profile of 溴乙酰溴
Property Insights of 溴乙酰溴
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 溴乙酰溴. With a topological polar surface area (TPSA) of 17.1 Ų, 溴乙酰溴 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 溴乙酰溴 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 溴乙酰溴?
The CAS number of 溴乙酰溴 is 598-21-0.
What is the molecular formula of 溴乙酰溴?
The molecular formula of 溴乙酰溴 is C2H2Br2O.
What is the molecular weight of 溴乙酰溴?
The molecular weight of 溴乙酰溴 is 199.85 g/mol.
Where can I buy 溴乙酰溴?
You can request a quote for 溴乙酰溴 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 溴乙酰溴?
Yes, KEHONG BIO provides custom synthesis services for 溴乙酰溴 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.