溴氯海因
TL;DR: 溴氯海因 (CAS 126-06-7) is a chemical compound with molecular formula C5H6BrClN2O2 and molecular weight 239.93 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
溴氯海因
3-bromo-1-chloro-5,5-dimethylimidazolidine-2,4-dione
Also Known As: 3-BROMO-1-CHLORO-5,5-DIMETHYLHYDANTOIN, agribron, aquabromn, aquabron, bromicidn
| Molecular Formula | C5H6BrClN2O2 |
|---|---|
| Molecular Weight | 239.93 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 40.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 239.93011 |
| Heavy Atoms | 11 |
| Complexity | 231.0 |
| Melting Point | 163-165 °C |
| Solubility | Sol in benzene, methylene dichloride, chloroform |
| Vapor Pressure | 0.0000066 [mmHg] |
Chemical Identifiers
| CAS Number | 126-06-7 |
|---|---|
| SMILES | CC1(C(=O)N(C(=O)N1Cl)Br)C |
| InChIKey | PQRDTUFVDILINV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 19 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
溴氯海因 (CAS 126-06-7), with molecular formula C5H6BrClN2O2 and molecular weight 239.93 g/mol. IUPAC: 3-bromo-1-chloro-5,5-dimethylimidazolidine-2,4-dione.
Chemical Property Profile of 溴氯海因
Property Insights of 溴氯海因
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 溴氯海因. With a topological polar surface area (TPSA) of 40.6 Ų, 溴氯海因 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 溴氯海因 has 0 hydrogen bond donor(s) and 2 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 溴氯海因?
The CAS number of 溴氯海因 is 126-06-7.
What is the molecular formula of 溴氯海因?
The molecular formula of 溴氯海因 is C5H6BrClN2O2.
What is the molecular weight of 溴氯海因?
The molecular weight of 溴氯海因 is 239.93 g/mol.
Where can I buy 溴氯海因?
You can request a quote for 溴氯海因 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 溴氯海因?
Yes, KEHONG BIO provides custom synthesis services for 溴氯海因 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.