phenyl 6-bromo-8-chloro-2-oxo-2H-chromene-3-carboxylate
TL;DR: phenyl 6-bromo-8-chloro-2-oxo-2H-chromene-3-carboxylate (CAS 305362-12-3) is a chemical compound with molecular formula C16H8BrClO4 and molecular weight 377.93 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
phenyl 6-bromo-8-chloro-2-oxochromene-3-carboxylate
Also Known As: phenyl 6-bromo-8-chloro-2-oxo-2H-chromene-3-carboxylate, phenyl 6-bromo-8-chloro-2-oxochromene-3-carboxylate
| Molecular Formula | C16H8BrClO4 |
|---|---|
| Molecular Weight | 377.93 g/mol |
| LogP | 4.4281 |
| Topological Polar Surface Area | 56.51 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 377.92944 |
| Heavy Atoms | 22 |
| Complexity | 918.57227 |
Chemical Identifiers
| CAS Number | 305362-12-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)OC(=O)C2=CC3=CC(=CC(=C3OC2=O)Cl)Br |
Product Overview
phenyl 6-bromo-8-chloro-2-oxo-2H-chromene-3-carboxylate (CAS 305362-12-3), with molecular formula C16H8BrClO4 and molecular weight 377.93 g/mol. IUPAC: phenyl 6-bromo-8-chloro-2-oxochromene-3-carboxylate.
Chemical Property Profile of phenyl 6-bromo-8-chloro-2-oxo-2H-chromene-3-carboxylate
Property Insights of phenyl 6-bromo-8-chloro-2-oxo-2H-chromene-3-carboxylate
The XLogP value of 4.4281 indicates that phenyl 6-bromo-8-chloro-2-oxo-2H-chromene-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.51 Ų, phenyl 6-bromo-8-chloro-2-oxo-2H-chromene-3-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, phenyl 6-bromo-8-chloro-2-oxo-2H-chromene-3-carboxylate has 0 hydrogen bond donor(s) and 4 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 phenyl 6-bromo-8-chloro-2-oxo-2H-chromene-3-carboxylate?
The CAS number of phenyl 6-bromo-8-chloro-2-oxo-2H-chromene-3-carboxylate is 305362-12-3.
What is the molecular formula of phenyl 6-bromo-8-chloro-2-oxo-2H-chromene-3-carboxylate?
The molecular formula of phenyl 6-bromo-8-chloro-2-oxo-2H-chromene-3-carboxylate is C16H8BrClO4.
What is the molecular weight of phenyl 6-bromo-8-chloro-2-oxo-2H-chromene-3-carboxylate?
The molecular weight of phenyl 6-bromo-8-chloro-2-oxo-2H-chromene-3-carboxylate is 377.93 g/mol.
Where can I buy phenyl 6-bromo-8-chloro-2-oxo-2H-chromene-3-carboxylate?
You can request a quote for phenyl 6-bromo-8-chloro-2-oxo-2H-chromene-3-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for phenyl 6-bromo-8-chloro-2-oxo-2H-chromene-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for phenyl 6-bromo-8-chloro-2-oxo-2H-chromene-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.