6-Bromo-3-(2-sulfanylethyl)-2h-chromen-2-one
TL;DR: 6-Bromo-3-(2-sulfanylethyl)-2h-chromen-2-one (CAS 80284-77-1) is a chemical compound with molecular formula C11H9BrO2S and molecular weight 283.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-bromo-3-(2-sulfanylethyl)chromen-2-one
Also Known As: 6-bromo-3-(2-sulfanylethyl)-2h-chromen-2-one, 6-bromo-3-(2-sulfanylethyl)chromen-2-one, 6-Bromo-3-(2-sulfanylethyl)-2H-1-benzopyran-2-one
| Molecular Formula | C11H9BrO2S |
|---|---|
| Molecular Weight | 283.95 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 27.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 283.95065 |
| Heavy Atoms | 15 |
| Complexity | 290.0 |
Chemical Identifiers
| CAS Number | 80284-77-1 |
|---|---|
| SMILES | C1=CC2=C(C=C1Br)C=C(C(=O)O2)CCS |
| InChIKey | ALOKADKMORMDEA-UHFFFAOYSA-N |
Product Overview
6-Bromo-3-(2-sulfanylethyl)-2h-chromen-2-one (CAS 80284-77-1), with molecular formula C11H9BrO2S and molecular weight 283.95 g/mol. IUPAC: 6-bromo-3-(2-sulfanylethyl)chromen-2-one.
Chemical Property Profile of 6-Bromo-3-(2-sulfanylethyl)-2h-chromen-2-one
Property Insights of 6-Bromo-3-(2-sulfanylethyl)-2h-chromen-2-one
The XLogP value of 3.2 indicates that 6-Bromo-3-(2-sulfanylethyl)-2h-chromen-2-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 27.3 Ų, 6-Bromo-3-(2-sulfanylethyl)-2h-chromen-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Bromo-3-(2-sulfanylethyl)-2h-chromen-2-one has 1 hydrogen bond donor(s) and 3 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 6-Bromo-3-(2-sulfanylethyl)-2h-chromen-2-one?
The CAS number of 6-Bromo-3-(2-sulfanylethyl)-2h-chromen-2-one is 80284-77-1.
What is the molecular formula of 6-Bromo-3-(2-sulfanylethyl)-2h-chromen-2-one?
The molecular formula of 6-Bromo-3-(2-sulfanylethyl)-2h-chromen-2-one is C11H9BrO2S.
What is the molecular weight of 6-Bromo-3-(2-sulfanylethyl)-2h-chromen-2-one?
The molecular weight of 6-Bromo-3-(2-sulfanylethyl)-2h-chromen-2-one is 283.95 g/mol.
Where can I buy 6-Bromo-3-(2-sulfanylethyl)-2h-chromen-2-one?
You can request a quote for 6-Bromo-3-(2-sulfanylethyl)-2h-chromen-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Bromo-3-(2-sulfanylethyl)-2h-chromen-2-one?
Yes, KEHONG BIO provides custom synthesis services for 6-Bromo-3-(2-sulfanylethyl)-2h-chromen-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.